OREdunitz.xml Guide to The Jack Dunitz Papers 1927-2009 Dunitz (Jack) Papers Finding aid prepared by Chris Petersen, Ryan Wick, and Trevor Sandgathe. Special Collections, The Valley Library
121 The Valley Library Oregon State University Corvallis, OR 97331 Phone: 541-737-2075 Email: special.collections@oregonstate.edu Web: http://osulibrary.oregonstate.edu/specialcollections
2011 Finding aid encoded by Chris Petersen, Ryan Wick, and Trevor Sandgathe. 2011 Finding aid written in English. Overview of the Collection Oregon State University Oregon State University Libraries, Special Collections & Archives Research Center
121 The Valley Library Oregon State University Corvallis, OR 97331 Phone: 541-737-2075 Email: special.collections@oregonstate.edu Web: http://osulibrary.oregonstate.edu/specialcollections
MSS Dunitz Dunitz, Jack D. Jack Dunitz Papers 1927-2009 30 linear feet 67 boxes 42.9 megabytes Personal correspondence, institutional records, research notes, scientific articles and reprints, teaching materials, manuscripts and photographs. Jack Dunitz (b. 1923) is an internationally recognized crystallographer and expert on molecular structure. Over the course of his lengthy career - including more than three decades spent at the Swiss Federal Institute of Technology - Dunitz has established himself as a leading expert in his field. He is responsible for several major structural discoveries, the refinement of numerous crystallographic techniques, and the publication of nearly four-hundred scientific articles and reviews. The Dunitz Papers include personal correspondence, institutional records, research notes, scientific articles and reprints, teaching materials, manuscripts and photographs, the bulk of which date from 1941 to 2008. English German

Physical quality of materials in The Jack Dunitz Papers ranges from good to very good.

 Biographical Note

Jack David Dunitz was born on March 29, 1923 in Glasgow, Scotland. He attended primary and secondary school in Glasgow, where he established himself as an intelligent child and a capable rugby player. It was during this time that he first became interested in chemistry, leading him to pursue a Bachelor's Degree in Chemistry at Glasgow University in 1940. Due to the strains of World War II, Dunitz's studies at Glasgow were condensed into three years and, following graduation, he entered the university's doctoral program under the supervision of John Monteath Robertson. Largely due to the pressures of Robertson's official responsibilities, Dunitz's experience as a doctoral student was primarily one of self-motivated learning and informal collaboration with other students. It was during this time that he began to work intensively with x-ray crystallography. He was assigned to the determination of the crystal structures of acetylenedicarboxylic acid dihydrate and diacetylenedicarboxylic acid dihydrate - a difficult and tedious process that took three years to complete.

At Glasgow Dunitz became familiar with the work of Dorothy Crowfoot Hodgkin, an internationally known crystallographer. Upon receiving his Ph.D., he took a position at Oxford as a postdoctoral researcher under Hodgkin's supervision. During his time in her laboratory, Dunitz met some of the most influential figures in twentieth century science including Sir Lawrence Bragg, John Desmond Bernal, and Max Perutz. There, he embarked on an extensive research program that included determining the structure of a calciferol derivative - a molecule that, at the time, was the most complex structure ever determined through means of x-ray crystallography - and the study of a tetraphenylcyclobutane structure. Through this work, he was introduced to Verner Schomaker who suggested that Dunitz begin gas-phase electron diffraction studies and helped to equip Dunitz with a research fellowship at the California Institute of Technology. After completing his work at Oxford, Dunitz left England for California where, in 1948, he began his work at Caltech. There, he met many of the scientists responsible for developing the field of modern structural chemistry including Linus Pauling and Robert Corey.

After three years at Caltech, Dunitz returned to Oxford where he learned theoretical chemistry from fellow researcher Leslie Orgel. It was during this period that Dunitz, Orgel, Sydney Brenner, and Dorothy Hodgkin visited Francis Crick and James Watson at Cambridge and became some of the first people to see the double helix model of DNA. After a year of work on ferrocene at Oxford, Dunitz returned to Caltech accompanied by his new bride, Barbara. While there, he met Alexander Rich and was recruited to set up a structural chemistry lab at the NIH Institute of Mental Health. Unfortunately, he quickly found himself uncomfortable at the NIH and returned to England, where he accepted a position as Senior Research Fellow at the Davy-Farraday Laboratory at The Royal Institution in London. Despite working under Sir Lawrence Bragg, who had dedicated himself to protein crystallography, Dunitz continued his collaboration with Leslie Orgel in the application of crystal-field theory.

In the early fall of 1957, Dunitz was offered an associate professorship at the Swiss Federal Institute of Technology with an explicit order to create a first class x-ray crystallography group. He took the position in October 1957 and was promoted to Full Professor in 1964. Supported by the security of a permanent position and a great deal of autonomy, Dunitz began to apply the skills he had learned at Oxford and Caltech. He began work on synthetic ionophores, medium-ring compounds, relationships between crystal and chemical systems, phase transformations, and advanced crystallographic methods - a research program that he continued until his retirement in 1990. During his time in Zurich, he received extensive recognition from the international scientific community, resulting in awards, fellowships, and invitations of membership from the London Chemical Society, Harvard University, the Swiss Chemical Society, the Royal Swedish Academy of Science, and the American Crystallographic Association, among others. Dunitz has published nearly four hundred research articles and reviews as well as several texts on structural chemistry.

 Timeline for Jack Dunitz 1923 Jack David Dunitz is born on March 29 in Glasgow, Scotland to William and Mildred Dunitz. 1944 Dunitz graduates from Glasgow University with a bachelor of science degree. 1946 Dunitz accepts a position as research fellow at the Chemical Crystallography Laboratory at Oxford University. 1947 Dunitz earns his Ph.D. at Glasgow University under the supervision of J. Monteath Robertson. 1948 The California Institute of Technology employs Dunitz as an A. A. Noyes Research Fellow. 1951 Dunitz returns to Oxford University as a research fellow in the Chemical Crystallography Laboratory. 1953 After completing his work at Oxford, Dunitz returns to the California Institute of Technology for a second A. A. Noyes Research Fellowship. Jack Dunitz and Barbara Steuer are married on August 11, 1953 at Den Hague, Holland. 1954 Dunitz serves as a visiting scientist at the National Institutes of Health in Bethesda, Maryland. 1955 Marguerite Dunitz, Jack and Barbara's first child, is born on May 14, 1955 in Bethesda, Maryland. 1956 Dunitz takes a position as Senior Research Fellow at the Davy-Faraday Research Laboratory at The Royal Institution in London. 1957 Julia Dunitz, Jack and Barbara's second child, is born on April 15, 1957 in London, England. Dunitz assumes a position as Professor of Chemical Crystallography at the Swiss Federal Institute of Technology in Zurich, Switzerland. 1964 Dunitz is promoted to full Professor of Chemical Crystallography at the Swiss Institute of Technology. 1968 Dunitz accepts an Overseas Fellowship at Churchill College, Cambridge. 1974 Dunitz is elected a Fellow of the Royal Society of London. 1977 Dunitz is awarded the Centenary Medal from the Chemical Society in London. 1979 Dunitz is appointed Foreign Member of the Royal Netherlands Academy of Sciences. That same year, Dunitz is named a member of the Deutsche Akademie der Naturforscher Leopoldina. 1980 Dunitz is honored as the 1980 Havinga Lecturer by the University of Leiden. 1981 Dunitz is named a fellow of the American Association for the Advancement of Science. 1985 Dunitz receives the Tishler Award at Harvard University. 1986 The Swiss Chemical Society awards Dunitz with the Paracelsus Prize. 1988 Dunitz becomes a Foreign Associate of the U.S. National Academy of Sciences. 1989 Dunitz joins the Academia Europaea. That same year, Dunitz is awarded the Bijvoet Medal by the University of Utrecht. 1990 After thirty-three years of service to the Swiss Federal Institute of Technology, Dunitz retires. In due course, Dunitz receives an honorary doctorate from the Israel Institute of Technology, becomes an Honorary Member of the Swiss Society of Crystallography and receives the Gregori Aminoff Prize from the Royal Swedish Academy of Sciences. 1991 Dunitz joins the European Academy of Sciences and Arts. That same year, Dunitz receives the Buerger Award from the American Crystallographic Association. 1992 The Weizmann Institute of Science awards Dunitz with an honorary Ph. D. 1997 Dunitz is appointed Foreign Honorary Member of the American Academy of Arts and Sciences and also joins the American Philosophical Society as a Foreign Member. The American Chemical Society likewise awards Dunitz with the Arthur C. Cope Scholar Award. 1999 Dunitz receives an honorary doctorate of science from Glasgow University. 2000 Dunitz becomes an Honorary Fellow of the Royal Society of Chemistry. 2004 The Swiss Chemical Society appoints Dunitz as Honorary Member. Content Description

The Jack Dunitz Papers include 30 linear feet of personal correspondence, institutional records, research notes, scientific articles and reprints, teaching materials, and manuscripts spanning his career from 1941-2008. In addition, 42.9 megabytes of born digital letters and manuscripts originally created using WriteNow word processing software have been converted to contemporary file types, printed out and organized into the collection's paper files. Materials are in English and German.

 Arrangement

The Jack Dunitz Papers have been organized into six series which are further arranged either alphabetically or chronologically, as appropriate. In addition to traditional archival materials, the collection includes a large volume of born digital word processing files, which have been printed out and inserted into the paper collection. An electronic repository of the born digital component of the collection in its original state is maintained on site.

 Restrictions on Access

Permission to examine The Jack Dunitz Papers will be granted to qualified researchers upon completion of an "Application for Use" form, and contingent upon the researcher's agreement to abide by the rules and policies governing collection use. See the Use of Collections page for more information

 Restrictions on Use

Portions of specified folders are restricted.

 Preferred Citation

Courtesy of The Jack Dunitz Papers, Special Collections, Oregon State University Libraries

 Custodial History

All materials in The Jack Dunitz Papers were received by OSU Libraries Special Collections from Jack Dunitz via post between March 29, 2010 and May 17, 2010.

 Acquisition Information

All physical materials (30 linear feet) were received by OSU Libraries Special Collections from Jack Dunitz via post on March 29, 2010.

All born digital materials (42.9 megabytes) were received by OSU Libraries Special Collections from Jack Dunitz via post on May 17, 2010.

 Future Additions

Processing Note

Final arrangement by Chris Petersen, Reed Strickland and Trevor Sandgathe.

 Books by Jack Dunitz Dunitz, Jack . X-Ray Analysis and the Structure of Organic Molecules , First Edition. Ithaca, NY: Cornell University Press 1979 . Dunitz, Jack . X-Ray Analysis and the Structure of Organic Molecules , Second Edition. Basel, Switzerland: Verlag Helvetica Chimica Acta 1995 . Dunitz, Jack and Heilbronner, E. Reflections on Symmetry in Chemistry...and Elsewhere . Basel, Switzerland: Verlag Helvetica Chimica Acta; Weinheim, Germany: VCH 1993 . Dunitz, Jack and Bürgi, H.B. Structure Correlation , Volumes 1 & 2. Weinheim, Germany: VCH 1994 . Related Materials

Related materials can be found in The Ava Helen and Linus Pauling Papers and A Liking for the Truth: Truth and Controversy in the Work of Linus Pauling event website, as hosted by the Oregon State University Libraries Special Collections.

 Separated Materials

Not all correspondence was deposited with the collection and separated material may no longer be extant.

 Subjects

The following Library of Congress Authorities headings suggest topics, individuals or organizations interspersed through the collection.

Personal Names Gajdusek, D. Carleton (Daniel Carleton), 1923-2008. Pauling, Linus, 1901-1994. Prelog, V. (Vladimir), 1906-1998. Robertson, J. Monteath (John Monteath) Bürgi, Hans-Beat. Gajdusek, D. Carleton (Daniel Carleton), 1923-2008. Hodgkin, Dorothy, 1910-1994. Orgel, Leslie E. Pauling, Linus, 1901-1994. Trueblood, Kenneth N. Organizational Names California Institute of Technology. Cambridge Crystallographic Data Centre. Eidgenössische Technische Hochschule Zürich. University of Glasgow. Subject Terms Crystallography. Molecular structure. X-ray crystallography. Photographic prints. Colleges and Universities Science California Electronic Records Photographs

The following section contains a detailed listing of the materials in the collection.

1 Correspondence and Non-Dunitz Publications 1932-2009 undated 26 boxes

The folders in this series contain correspondence and publications by specific authors, as maintained by Dunitz. The correspondence materials include traditional letters as well as a large volume of emails and word processing files printed out over time by Dunitz. Highlights of the series include lengthy exchanges with a number of notable scientists including Carleton Gajdusek, Dorothy Hodgkin and Kenneth Trueblood. The activities of the Cambridge Crystallographic Data Centre are also well-documented in this series, as is Dunitz's work in preparing his Biographical Memoirs of the Royal Society article on Linus Pauling.

 1.001 Correspondence: A 1976-2008 undated 16 folders 1.1 Abir-Am, Pnina 2001 1.2 Abrahams, Sidney C. 1982 2000 1.3 Academia Europaea 1989 1991 1994-1995 1.4 Accounts of Chemical Research 1994-1995 undated 1.5 Acta Crystallographica 1976 1986 1989-1995 undated 1.6 Allinger, Norman L. 1992 1997 1999 1.7 American Academy of Arts and Sciences 1997 1.8 American Chemical Society 1989 1992 1996-1997 1.9 American Crystallographic Association 1989-1991 1994 1.10 American Philosophical Society 1997-1998 1.11 Angewandte Chemie 1990-1992 1994-1996 undated 1.12 Anwar, Jamshed 2005 1.13 Arrhenius, Gustav 1992 2008 1.14 Auf der Hyde, Thomas 1990-1994 1.15 Avnir, David 1992-1996 1.16 A: General Correspondence 1.002 Correspondence: Ba 1982-2009 3 folders 2.1 Bader, Richard 1982-2009

Includes extensive correspondence with Vladimir Tsirelson regarding Richard Bader.

 2.2 Barron, Laurence D. 1988-1989 1993-1996 2001-2002 2004 2.3 Baur, Werner 1997-1998 1.003 Correspondence: Be - Bo 1960-2004 10 folders 3.1 Benner, Steven 2004 3.2 Bent, Henry A. 1960-1968

Publications only.

 3.3 Bijvoet, Johannes Martin 1967-2001

Includes portrait of Bijvoet, dated 1961.

 3.4 Biopolymers 1997 3.5 Blow, David M. 2002 3.6 Boese, Roland 1990-1991 1999 2001 3.7 Boldyreva, Elena 1991-1993 3.8 Boll-Dornberger, Kate 1963-1967 3.9 Bombicz, Petra 2001-2002 3.10 Boorstin, Daniel 1999 1.004 Correspondence: Br - Bu 1954-2004 9 folders 4.1 Braga, Dario 2001 4.2 Bragg, W. L. 1954-1955 1957-1958 4.3 Breau, Josef 1998-1999 4.4 Brenner, Sydney 1994 2000 4.5 Britton, Doyle 1965 1973-1982 1990 1998 4.6 Brock, Carol 1984-2000 4.7 Buck, Henk M. 1999-2000 4.8 Bürgi, Hans-Beat 1969-2004 4.9 B: General Correspondence 1.005 Cambridge Crystallographic Data Centre 1988-2004 undated 4 folders

Portions of the CCDC files are restricted.

 5.1 Cambridge Crystallographic Data Centre 1988-1995 5.2 Cambridge Crystallographic Data Centre 1996 5.3 Cambridge Crystallographic Data Centre 1997 5.4 Cambridge Crystallographic Data Centre 1998-2004 undated 1.006 Correspondence: C 1944-2007 undated 13 folders 6.1 California Institute of Technology 1948-1950 1952 1954 2007

Folder contains audio files, transcripts and correspondence related to the "C. I. T. Cabaret" - stage productions and song parodies created for Christmas Party celebrations from 1948-1950, as well as "The Road to Stockholm" production performed in honor of Linus Pauling's receipt of the Nobel Chemistry Prize.

 6.2 Cambridge, University of 1951 6.3 Cameron, T. Stanley 1991 1996 1999-2000 6.4 Carnegie Trust 1944 1946 1948 6.5 Castellano, Ronald K. 2002 6.6 Chakrabarti, Pinakpani 1989 1993-1998 2000 6.7 Chemical Physics Letters 1995-1998 undated 6.8 Cornell University Press 1993-1994 6.9 Cotton, F. Albert 2000 6.10 Coulson, Charles A. 1949 1951 1963 1968 1971 6.11 Crick, Francis 1956 6.12 Cruickshank, D. W. J. 1977 1991 1996-1997 2001 6.13 C: General Correspondence 1.007 Correspondence: D 1946-2008 11 folders 7.1 Dougherty, Dennis A. 1993 1997 7.2 Delbrück, Max 1967 1969 1990 7.3 Dervan, Peter 1992-1999 7.4 Desiraju, Guatam 1992-2005 7.5 Deutsche Akademie der Naturforscher Leopoldina 1980-2008 7.6 Diederich, François 1991-1998 7.7 Dobler, Max 1983 7.8 Donohue, Jerry 1956 1967-1983 7.9 Dunitz, Marguerite 1998 7.10 Dunlop, W. R. 1946-1947

Contains materials related to Dunitz's participation in Dunlop's "Correspondence Course on Analysis and Language."

 7.11 D: General Correspondence 1.008 Correspondence: E 1966-2006 9 folders 8.1 Egli, Martin 1988-2006 8.2 Eijck, Boucke van 1996 1999-2000 2002 8.3 Elguero, Jose 1991-1998 2005 8.4 Eliel, Ernest L. 1973-1998 8.5 Ermer, Otto 1966-1993 8.6 Eschenmoser, Albert 1988-1989 2005 8.7 European Academy of Sciences and Arts 1991-1992 1999 2004 8.8 European Science Foundation 1999-2003 8.9 E: General Correspondence 1.009 Correspondence: F 1957-1999 6 folders 9.1 Flack, Howard 1998-1999 9.2 Forrest, Hugh S. 1994 1997 9.3 Freeman, Hans C. 1957 1988-1989 9.4 French, Alfred D. 1999 9.5 Fundacion BBV 1991-1992 1997-1998 9.6 F: General Correspondence 1.010 Correspondence: Ga 1989-2008 3 folders 10.1 Gajdusek, D. Carleton 1994-2008

Includes images of Caltech graduate student colleagues, including Jack Dunitz, on camping trips circa 1948. Also includes two photographs of Gajdusek at his own eightieth birthday party.

 10.2 Gatti, Carlo 2003-2004 10.3 Gavezzotti, Angelo 1989 1994 1996-2006 1.011 Correspondence: Gi - Gu 1971-2000 6 folders 11.1 Gillespie, Ron 1990-1994 11.2 Ginsburg, David 1971-1990 11.3 Glusker, Jenny 1994-1995 1999-2000 11.4 Gould, Stephen Jay 1998 11.5 Gunsteren, Wilfred van 1995

Publications only.

 11.6 G: General Correspondence 1.012 Correspondence: H 1934-2007 undated 12 folders 12.1 Hager, Tom 1995-1996 2006 12.2 Hargittai, Istvan and Magdolna 1991-1992 1995-1999 12.3 Harris, Kenneth D. M. 1996 1999 2002 2006 12.4 Harvard University 1993-1995 12.5 Heilbronner, Edgar 1956-1957 1973-1998 12.6 Helvetica Chimica Acta 1990-1991 2003 undated 12.7 Herbstein, Frank H. 1974-2007 12.8 Hirshfeld, Fred L. 1982-1986 12.9 Hodgkin, Dorothy 1934 1939-1940 1950-1951 1956-1999

Includes color negative of oil portrait of Dorothy Hodgkin.

 12.10 Hoffman, Roald 1993 1996 2006 12.11 Huber-Buser, Effi 1962-1970 12.12 H: General Correspondence 1.013 Correspondence: I - K 1958-2008 undated 21 folders 13.1 Ibers, James 1972-1991 2008 13.2 Inorganic Chemistry 1991 undated 13.3 Irwin, John Joseph 1987-1995

Includes a copy of Irwin's Ph. D. thesis, "The Cambridge Structural Database as a New Scientific Tool."

 13.4 I: General Correspondence 13.5 Jortner, Joshua 1994 13.6 Journal of the American Chemical Society 1990-1991 1994-1995 undated 13.7 Journal of Physical Chemistry 1989 13.8 Journal of Physical Organic Chemistry 1991 1994 undated 13.9 J: General Correspondence 13.10 Kalman, Alajos 1990 1992 2000-2003 13.11 Kamb, Linda Pauling 1993 1995-1997 13.12 Karplus, Martin 1988 1994-1995 13.13 Kendrew, John 1958 13.14 Kennard, Olga 1967 1982 1992 1995-1996 2006 13.15 Kirby, Anthony J. 1984 1991 1993-1994 13.16 Klebe, Gerhard 1993 1996 13.17 Koshland, Daniel E., Jr. 1993-1994 13.18 Kresinski, Roman 1997 13.19 Kroon, Jan 1980 1996-1997 1999-2000 13.20 Kuhn, Hans 1962-1963 13.21 K: General Correspondence 1.014 Laboratory Research Assistant Applicants - Post-Doctoral and Sabbatical 22 folders 14.1 Laboratory Research Assistant Applicants: A 14.2 Laboratory Research Assistant Applicants: B 14.3 Laboratory Research Assistant Applicants: C 14.4 Laboratory Research Assistant Applicants: D 14.5 Laboratory Research Assistant Applicants: E 14.6 Laboratory Research Assistant Applicants: F 14.7 Laboratory Research Assistant Applicants: G 14.8 Laboratory Research Assistant Applicants: H 14.9 Laboratory Research Assistant Applicants: I - J 14.10 Laboratory Research Assistant Applicants: K 14.11 Laboratory Research Assistant Applicants: L 14.12 Laboratory Research Assistant Applicants: M 14.13 Laboratory Research Assistant Applicants: N 14.14 Laboratory Research Assistant Applicants: O 14.15 Laboratory Research Assistant Applicants: P - Q 14.16 Laboratory Research Assistant Applicants: R 14.17 Laboratory Research Assistant Applicants: S 14.18 Laboratory Research Assistant Applicants: T 14.19 Laboratory Research Assistant Applicants: U 14.20 Laboratory Research Assistant Applicants: V 14.21 Laboratory Research Assistant Applicants: W 14.22 Laboratory Research Assistant Applicants: X - Z 1.015 Correspondence: L 1950-2004 9 folders 15.1 Lahav, Meir and Leslie Leiserowitz 1993-1995 2002-2004 15.2 Laube, Thomas 1988 1995-1996 15.3 Leonard, Nelson J. 1960 1974 1996 15.4 Lerner, Richard 1994-1998 15.5 Lifson, Shneoir 1999 15.6 Linden, Anthony 2000 15.7 Lipscomb, William 1951-1952 15.8 Lonsdale, Kathleen 1950-1951 1998 15.9 L: General Correspondence 1.016 Correspondence: M 1956-2004 undated 12 folders 16.1 Mackay, Alan L. 1973-1975 1984-1990 16.2 MacKinnon, Roderick 1998 16.3 Maddox, Brenda 1999 2002 16.4 Mandel, George 1956-1957

Folder includes series of x-ray crystallographic photographs of Guanine and Azoguanine taken by Mandel.

 16.5 Mason, Stephen 1978-1991 1996 16.6 McBride, J. Michael 1991-1992 1998 2002 16.7 McGrayne, Sharon 1991 16.8 Mislow, Kurt 1991 1995-1996 16.9 Mnyukh, Yuri 2002-2003 16.10 Molecular Physics 1994 undated 16.11 Murray-Rust, Peter 1975-1976 2004 16.12 M: General Correspondence 1.017 Correspondence: N 1954-1999 undated 6 folders 17.1 National Academy of Sciences 1988 1993 1998-1999 17.2 National Institutes of Health 1954-1955 17.3 Nature 1963-1964 1991 1993 undated 17.4 Novotny-Bregger, Elisabeth 1991-1994 17.5 Nyholm, Ronald S. 1957-1960 17.6 N: General Correspondence 1.018 Correspondence: O 1949-2002 6 folders 18.1 Olovsson, Ivar 1990-1993 2001-2002 18.2 Orgel, Leslie 1952-1958 1964 1995-1998 18.3 Oster, Gerald 1949 18.4 Ovchinnikov, Yuri A. 1969 18.5 Oxford, University of 1951-1953 18.6 O: General Correspondence 1.019 Pauling, Linus 1950-2001 2 folders 19.1 Pauling, Linus 1950-1994 19.2 Materials re: Biographical Memoirs of the Royal Society article on Linus Pauling, written by Jack Dunitz 1994-2001 1.020 Correspondence: P - Q 1952-2007 11 folders 20.1 Patterson, A. Lindo 1955 20.2 Pauling, Peter 1966 1970 1998-2000 20.3 Perutz, Max 1955-1956 1958 1994 1997 2002 20.4 Pepinsky, Ray 1952 1957-1960 20.5 Petsko, Gregory 1992 20.6 Phillips, David C. 1957-1958 1963-1964 1966 1977 1990-1999 20.7 Popelier, David 2006-2007 20.8 Prelog, Vladimir 1957 1987 1995 20.9 P: General Correspondence 20.10 Quack, Martin 1989 1992-2002 20.11 Q: General Correspondence 1.021 Correspondence: R 1932-2008 undated 9 folders 21.1 Rich, Alexander 1957 1974 1994-1995 2000 21.2 Roberts, Jack 1995 undated 21.3 Robertson, J. Monteath 1934-1959

Publications only.

 21.4 Rollett, John S. 1954-1955 21.5 Royal Institution 1955 21.6 Royal Society 1974-2008

Portions of this file are restricted.

 21.7 Rundle, R.E. 1950-1964 21.8 Ruzicka, Leopold 1932 1934-1935 1956-1957 1973-1976

Includes one letter written to Ruzicka by J. D. Bernal.

 21.9 R: General Correspondence 1.022 Correspondence: Sa - Sp 1948-2005 15 folders 22.1 Sanders, Jeremy K. M. 1995 22.2 Sands, Donald 1976-1991 22.3 Sarma, J. A. R. P. 1986 1989-1991 22.4 Saunders, Martin 1988-1989 1992-1993 2002 22.5 Schmidt, Gerhard 1965-1966 22.6 Schmidtchen, Franz P. 2003 22.7 Schomaker, Verner 1948 1970 1995-1996 22.8 Seebach, Dieter 1988-2005 22.9 Seiler, Paul 1976-2003 22.10 Shaik, Sason 1993-1994 22.11 Shankland, Norman 1998 22.12 Shearer, Harrison 1957 22.13 Sim, George A. 1966 22.14 Somorjoi, Gabor 1987 1993 2004 22.15 Spek, Anthony L. 1998-2000 1.023 Correspondence: St - Su 1968-2004 5 folders 23.1 Steiner, Thomas 1996-1997 23.2 Stent, Gunther 1968-2004 23.3 Stølevik, Reidar 1996 23.4 Sutherland, G. B. B. M. 1955 23.5 S: General Correspondence 1.024 Correspondence: T - V 1951-2006 12 folders 24.1 Tame, Jeremy 2006 24.2 Tanaka, Jiro 1972-1973 1987 24.3 Taylor, W. H. 1951 24.4 Third World Academy of Sciences 1989-2002 24.5 Thomas, John Meurig 1989-2002 24.6 Trueblood, Ken 1956-1980 24.7 Trueblood, Ken 1981-1998 24.8 T: General Correspondence 24.9 U: General Correspondence 24.10 Venkatesan, K. 1988-1992 24.11 Vincent, Beverly 1987 1991 1995-1996 24.12 V: General Correspondence 1.025 Correspondence: W 1959-2004 8 folders 25.1 Waser, Jurg 1971-1972 25.2 Watson, James 1997 25.3 Weizmann Institute of Science 1984-2004 25.4 Williams, Dudley 1993 2004 25.5 Willis, B. T. M. 1959 1963-1964 25.6 Wilson, Chick C. 2002 25.7 Wüthrich, Kurt 1998-2002

Publications only.

 25.8 W: General Correspondence 1.026 Correspondence: Y - Z 1985-2007 6 folders 26.1 Yang Qing-Chuan 1985-1991 26.2 Y: General Correspondence 26.3 Zagrovic, Bojan 2006-2007 26.4 Zahradník, Rudolf 1995 1998-1999 26.5 Zewail, Ahmed 1992-1999 26.6 Z: General Correspondence 2 Biographical Materials and Photographs 1967-2008 undated 2 boxes

A wide range of biographical data is contained in this small series. Of particular note is a collection of autobiographical typescripts written by Dunitz from 1988-1990. The handful of photographs found in series 2 are complemented by the Caltech graduate student images located in the Gajdusek correspondence file.

 2.001 Assorted Dunitz Biographical Materials 1967-2008 undated 12 folders 1.1 Magazine Article: "Return to Alma Mater," Chemistry in Britain February 1978

Article refers to Dunitz's delivery of a Centenary Lecture at Glasgow University.

 1.2 Typescripts: autobiographical remembrances by Jack Dunitz 1988-1990

Typescripts are titled La Primavera, Family Background, Pasadena (1948-51), Donde està la carretera para Mexico?, Back to Oxford (1951-53), Zurich and Notes on this and that.

 1.3 Magazine Article: "American Crystallographic Association to Meet in Toledo," Physics Today June 1991

Article contains reference to Dunitz's receipt of the Martin J. Buerger Award from the American Crystallographic Association.

 1.4 Typescript: Scientific Work of J. D. Dunitz, by Jack Dunitz [?] March 1996 1.5 Correspondence re: Dunitz family genealogy December 1996 1.6 Bound Volume: Arthur C. Cope Scholar Award, presented to Jack Dunitz at the 214th American Chemical Society National Meeting September 1997

Volume contains abstracts of 270 scientific papers authored by Dunitz.

 1.7 Typescript: Jack Dunitz. Oral history interview conducted by Istvan Hargittai September 6, 1999 1.8 Typescript: untitled memorial address delivered at the funeral of Jack Dunitz's brother-in-law, Harold Sellyn. Address written and delivered by Sellyn's son, who is unnamed November 2001 1.9 Typescript: Personal Records of Fellows of the Royal Society. Autobiographical data compiled by Jack Dunitz ca. 2004 1.10 Typescripts: Curriculum Vitae and List of Publications 2008 1.11 Typescript: Why My Great Grandparents Left England, by David J. Dunitz ca. 2000s

David Dunitz is Jack Dunitz's second cousin.

 1.12 Assorted Correspondence re: details of and reflections on Jack Dunitz's life and work 1967 1992 undated 2.002 Photographs 1973-2003 undated 4 folders 2.1 Jack Dunitz speaking with a colleague in a lecture hall at the Bürgenstock Conference, Switzerland. Photo courtesy of Jiro Tanaka 1973 2.2 Jack Dunitz engaged in discussion with A. I. Kitaigorodskii and Olga Kennard at the International Congress of Crystallography, Amsterdam. Photo courtesy of Olga Kennard 1973 2.3 Group photograph of participants, including Jack Dunitz, at a gathering in Wales. Photo by Grants Studio, Llanidloes ca. 1970s 2.4 Jack Dunitz posing outside an office with a younger unidentified colleague 2003 3 Publications by Jack Dunitz 1947-2004 8 boxes

Series 3 is comprised of reprints of scientific publications authored or co-authored by Jack Dunitz, as collected by Dunitz.

 3.001 Publications by Jack Dunitz 1947-1960 33 folders 1.1 The Crystal and Molecular Structure of Certain Dicarboxylic Acids. Part I. Oxalic Acid Dihydrate. J. Chem. Soc. (1947): 142-148. [J. D. Dunitz and J. M. Robertson] 1.2 The Crystal and Molecular Structure of Certain Dicarboxylic Acids. Part III. Diacetylenedicarboxylic Acid Dihydrate. J. Chem. Soc. (1947): 1145-1156. [J. D. Dunitz and J. M. Robertson] 1.3 Some Developments in Structural Chemistry. Oxford Science 2, 1 (June 1948): 24-34. [J. D. Dunitz and S. C. Wallwork] 1.4 Structure of Calciferol. Nature 162 (1948): 608-609. [D. Crowfoot and J. D. Dunitz] 1.5 The Structure of the Centrosymmetric Isomer of 1:2:3:4-Tetraphenylcyclobutane. Acta Crystallogr. 2 (1949): 1-13 1.6 The Constitution of the Dimer of Acenaphthylene. Acta Crystallogr. 2 (1949): 62. [J. D. Dunitz and L. Weissman] 1.7 X-ray Structure Analysis of Complex Organic Compounds. Research 3 (1950): 6-12 1.8 A Reinvestigation of the Structures of Chlorine Monoxide and Chlorine Dioxide by Electron Diffraction. J. Amer. Chem. Soc. 72 (1950): 3108-3112. [J. D. Dunitz and K. Hedberg] 1.9 X-ray Analysis of some Antibiotic Substances. J. Amer. Chem. Soc. 72 (1950): 4276. [J. D. Dunitz and J. E. Leonard] 1.10 The Crystal Structure of Chloramphenicol and Bromamphenicol. J. Amer. Chem. Soc. 74 (1952): 995-999 1.11 Purpurogallin: by X-ray Fourier Synthesis. Nature 169 (1952): 1087 1.12 Influence of Chain Length on the Symmetry of Conjugated Molecules. J. Chem. Phys. 20 (1952): 1328. [J. D. Dunitz and L. E. Orgel] 1.13 Bis-cyclopentadienyl iron: a Molecular Sandwich. Nature 171 (1953): 121-122. [J. D. Dunitz and L. E. Orgel] 1.14 Crystallography. Ann. Rep. Chem. Soc. for 1952 49 (1953): 343-381. [J. H. Robertson and J. D. Dunitz] 1.15 Electronic Structure of Metal bis-cyclopentadienyls. J. Chem. Phys. 23 (1955): 954-958. [J. D. Dunitz and L. E. Orgel] 1.16 Structure of Dithionite. J. Amer. Chem. Soc. 78 (1956): 878 1.17 The Crystal Structure of Ferrocene. Acta Crystallogr. 9 (1956): 373-375. [J. D. Dunitz, L. E. Orgel and A. Rich] 1.18 The Structure of Sodium Dithionite and the Nature of the Dithionite Ion. Acta Crystallogr. 9 (1956): 579-586 1.19 Comments on a Method of Structure Determination. Acta Crystallogr. 9 (1956): 537. [J. D. Dunitz and L. E. Orgel] 1.20 Stereochemistry of Cupric Compounds. Nature 179 (1957): 462-465. [L. E. Orgel and J. D. Dunitz] 1.21 Electronic Properties of Transition-metal Oxides - I. Distortions from Cubic Symmetry. J. Phys. Chem. Solids 3 (1957): 20-29. [J. D. Dunitz and L. E. Orgel] 1.22 Electronic Properties of Transition-metal Oxides - II. Cation Distribution amongst Octahedral or Tetrahedral Sites. J. Phys. Chem. Solids 3 (1957): 318-323. [J. D. Dunitz and L. E. Orgel] 1.23 Structure of Calciferol. Chemistry and Industry (1957): 1148-1149. [D. C. Hodgkin, M. S. Webster and J. D. Dunitz] 1.24 Structure of the Cyclododecane Molecule. Proc. Chem. Soc. (1958): 348-349 . [J. D. Dunitz and H. M. M. Shearer] 1.25 The Crystal Structure of the Cuprous Chloride Azomethane Complex. Acta Crystallogr. 13(1960): 28-34 . [I. D. Brown and J. D. Dunitz] 1.26 Structure of the Cyclododecane Molecule: Amendment. Proc. Chem. Soc. (1959): 268. [J. D. Dunitz and H. M. M. Shearer] 1.27 Les Structures des Cycles de Taille Moyenne. I. Un Examen aux Rayons X de quelques Sels de Cyclononylamine. Helv. Chim. Acta 43 (1960): 1-2. [R. F. Bryan et J. D. Dunitz] 1.28 Les Structures des Cycles de Taille Moyenne. II. La Structure Cristalline et Moléculaire du Bromure de Cyclononylammonium. Helv. Chim. Acta 43 (1960): 3-18. [R. F. Bryan et J. D. Dunitz] 1.29 Die Strukturen der mittleren Ringverbindungen. III. Die Struktur des Cyclododecans. Helv. Chim. Acta 43 (1960): 18-35. [J. D. Dunitz and H. M. M. Shearer] 1.30 Strukturen der mittleren Ringverbindungen. IV. 1,6-trans-Diaminocyclodecandihydrochlorid, trikline Modifikation. Helv. Chim. Acta 43 (1960): 760-768. [E. Huber-Buser and J. D. Dunitz] 1.31 The Crystal Structure of Diazoaminobenzene Copper (I). Acta Crystallogr. 14 (1961): 480-485. [I. D. Brown and J. D. Dunitz] 1.32 Röntgenographisch bestimmte Konformationen und Reaktivität mittlerer Ringe. Angew. Chem. 72 (1960): 896-902. [J. D. Dunitz and V. Prelog] 1.33 Struktur des Cycloheptatrien-molybdän-tricarbonyls, C7H8Mo(CO)3. Helv. Chim. Acta 43 (1960): 2188-2197. [J. D. Dunitz and P. Pauling] 3.002 Publications by Jack Dunitz 1961-1966 38 folders 2.1 The Crystal Structure of Chromium (II) Chloride. Acta Crystallogr. 14 (1961): 927-929. [J. W. Tracy, N. W. Gregory, E. C. Lingafelter, J. D. Dunitz, H. -C. Mez, R. E. Rundle, C. Scheringer, H. L. Yakel, Jr. and M. K. Wilkinson] 2.2 Kristallographische Daten für das vermutliche 1-Anilino-4-chlor-pyromellitsäure-di-phenylimid. Helv. Chim. Acta 44 (1961): 442-444. [J. D. Dunitz, H.-C. Mez, H. Hopff and B. K. Manukian] 2.3 Conformation of the Cyclodecane Ring. Proc. Chem. Soc. (1961): 463. [E. Huber-Buser, J. D. Dunitz and K. Venkatesan] 2.4 Die Strukturen der mittleren Ringverbindungen. V. 1,6-trans-Diaminocyclodecandihydrochlorid. Helv. Chim. Acta 44 (1961): 2027-2033. [E. Huber-Buser and J. D. Dunitz] 2.5 Die Strukturen der mittleren Ringverbindungen. VI. 1,6-cis-Diaminocyclodecan-dihydrochlorid. Helv. Chim. Acta 44 (1961): 2033-2041. [J. D. Dunitz and K. Venkatesan] 2.6 Stoffwechselprodukte von Actinomyceten. 32. Mitteilung. Über die Konstitution von Nonactin. Helv. Chim. Acta 45 (1962): 129-138. [J. Dominguez, J. D. Dunitz, H. Gerlach and V. Prelog] 2.7 Kristallstruktur des Benzol-Addukts des 1, 2, 3, 4-Tetramethyl cyclobutadien-nickel (II) - chlorids. Helv. Chim. Acta 45 (1962): 647-665. [J. D. Dunitz, H. -C. Mez, O. S. Mills and H. M. M. Shearer] 2.8 Nature of Orientational Defects in Ice. Nature 197 (1963): 860-862 2.9 The crystal structure of aureomycin (chlortetracycline) hydrochloride. Configuration, bond distances and conformation. J. Amer. Chem. Soc. 85 (1963): 851-856. [J. Donohue, J. D. Dunitz, K. N. Trueblood and M. S. Webster] 2.10 The Crystal Structure of a Calciferol Derivative. J. Chem. Soc. (1963): 4945-4956. [D. C. Hodgkin, B. M. Rimmer, J. D. Dunitz and K. N. Trueblood] 2.11 The Supposed Existence of two Molecular Forms in Crystals of Acetyl Choline Bromide. Acta Chem. Scand. 17 (1963): 1471-1472 2.12 The Structure of Patchouli Alcohol. Proc. Chem. Soc. (1963): 383. [M. Dobler, J. D. Dunitz, B. Gubler, H. P. Weber, G. Büchi and J. Padilla O.] 2.13 The Interpretation of Pseudo-orthorhombic Diffraction Patterns. Acta Crystallogr. 17 (1964): 1299-1304 2.14 Die Konformation des Bicyclo [3.3.1]nonan-Systems. I. Strukturanalyse des 3-Azabicyclo[3.3.1]nonan-hydrobromids. Helv. Chim. Acta 47 (1964): 695-704. [M. Dobler and J. D. Dunitz] 2.15 Die Strukturen der mittleren Ringverbindungen. VII. 1,6-trans-Dibromcyclodecan. Helv. Chim. Acta 47 (1964): 951-956. [J. D. Dunitz and H. P. Weber] 2.16 Die Strukturen der mittleren Ringverbindungen.VIII. Azacyclododecan-hydrochlorid. Helv. Chim. Acta 47 (1964): 1138-1147. [J. D. Dunitz and H. P. Weber] 2.17 The Crystal Structure of Silver Cyanate. Acta Crystallogr. 18 (1965): 424-428. [D. Britton and J. D. Dunitz] 2.18 Strukturbestimmung organischer Molekeln durch Röntgenanalyse. Analytische Chemie 205 (1964): 134-148 2.19 Polymorphism in Anhydrous Cobalt Sulphate. Acta Crystallogr. 18 (1965): 737-740. [J. D. Dunitz and P. Pauling] 2.20 Die Konfiguration des physiologisch wirksamen 2-Chlor-9-(w-dimethylaminopropyliden)-thioxanthens. Helv. Chim. Acta 47 (1964): 1897-1902. [J. D. Dunitz, H. Eser and P. Strickler] 2.21 Strucktur des Hexarhodano-kobalt(II)-di-quecksilber(II)-Benzol-Komplexes. Helv. Chim. Acta 47 (1964): 1889-1897. [R. Grønbaek and J. D. Dunitz] 2.22 Dorothy Crowfoot Hodgkin, Nobel Prize 1964 in Chemistry. Experientia 20 (1964): 710 2.23 Structure Analysis of Nickel (II)-1,8,8,13,13-pentamethyl-5-cyano-trans-corrin chloride. Proc. Roy. Soc. A288 (1965): 324-330. [J. D. Dunitz and E. F. Meyer, Jr.] 2.24 The Crystal Structure of Silver Fulminate. Acta Crystallogr. 19 (1965): 662-668. [D. Britton and J. D. Dunitz] 2.25 Pseudo-orthorhombic Diffraction Patterns and OD Structures. Acta Crystallogr. 19 (1965): 471-472. [K. Dornberger-Schiff and J. D. Dunitz] 2.26 The Crystal Structure of AgCN . 2AgNO3. Acta Crystallogr. 19 (1965): 815-820. [D. Britton and J. D. Dunitz] 2.27 Die Strukturen der mittleren Ringverbindungen. IX. 1,8-Diazacyclotetradecan-dihydrobromid. Helv. Chim. Acta 48 (1965) 1441-1449. [J. D. Dunitz and E. F. Meyer, Jr.] 2.28 Die Kristallstruktur von 1,4-trans-Diaminocyclohexan-dihydrochlorid. Helv. Chim. Acta 48 (1965): 1450-1456. [J. D. Dunitz and P. Strickler] 2.29 Die Kristallstruktur der 1,6-Methano-cyclodecapentaen-2-carbonsäure. Helv. Chim. Acta 48 (1965): 1429-1440. [M. Dobler and J. D. Dunitz] 2.30 Conformation of a Cyclo-octane Derivative. Chem. Comm. (1966): 166. [J. D. Dunitz and A. Mugnoli] 2.31 Refinement of the L-Alanine Crystal Structure. Acta Crystallogr. 21 (1966): 617-618. [J. D. Dunitz and R. R. Ryan] 2.32 Kristallographische Daten für Tris-isopropyliden-cyclopropan. Helv. Chim. Acta 49 (1966): 1680. [J. D. Dunitz and A. Mugnoli] 2.33 Preferred Rotational Conformation of Carboxyl Groups on the Cyclohexane Ring. Tetrahedron Letters 33 (1966): 3933-3934. [J. D. Dunitz and P. Strickler] 2.34 Die Strukturen der mittleren Ringverbindungen. X. 1,6-trans-Diaminocyclodecan-hydrochloride, monokline Modifikation. Helv. Chim. Acta 49 (1966): 1821-1827. [E. Huber-Buser and J. D. Dunitz] 2.35 Verfeinerung der Kristallstruktur von 1,4-trans-Diaminocyclohexan-dihydrochlorid. Helv. Chim. Acta 49 (1966): 2502-2505. [J. D. Dunitz and P. Strickler] 2.36 Die Kristallstruktur von 1,4-trans-Cyclohexan-dicarbonsäure. Helv. Chim. Acta 49 (1966): 2505-2515. [J. D. Dunitz and P. Strickler] 2.37 Die Strukturen der mittleren Ringverbindungen. XI. Cyclooctan-1,2-trans-dicarbonsäure. Helv. Chim. Acta 49 (1966): 2492-2502. [M. Dobler, J. D. Dunitz and A. Mugnoli] 2.38 Isomerism in a Macrocyclic Schiff Base Nickel (II) Complex: Structure of the β-isomer. Chem. Comm. (1966): 910. [R. R. Ryan, B. T. Kilbourn and J. D. Dunitz] 3.003 Publications by Jack Dunitz 1967-1974 35 folders 3.1 Preferred conformation of the carboxyl group. In Structural Chemistry and Molecular Biology: A Volume Dedicated to Linus Pauling by his Students, Colleagues, and Friends. Ed. A. Rich and N. Davidson. Freeman, 1968, pp. 595-602. [J. D. Dunitz and P. Strickler] 3.2 Structural and Strain-energy Consequences of "Intra-annular" Substitution in the Cyclodecane Ring. Chem. Comm. (1967): 360. [M. Bixon, H. Dekker, J. D. Dunitz, H. Eser, S. Lifson, C. Mosselman, J. Sicher and M. Svoboda] 3.3 The Crystal and Molecular Structure of μ4-oxohexa-μ-chlorotetrakis (pyridine copper (II)), Cu4Cl6O.4C5H5N, a Polynuclear Copper Complex. Inorg. Chim. Acta 1 (1967): 209-216. [B. T. Kilbourn and J. D. Dunitz] 3.4 Die Strukturen der mittleren Ringverbindungen. XII. Kristallstruktur der 1,1,5,5-Tetramethylcyclodecan-8-carbonsäure. Helv. Chim. Acta 50 (1967) 1565-1572.[J. D. Dunitz and H. Eser] 3.5 Die Strukturen der mittleren Ringverbindungen. XIII. Zwei neue Konformationen des Cyclodecanringes. Helv. Chim. Acta 50 (1967): 1572-1583. [J. D. Dunitz, H. Eser, M. Bixon and S. Lifson] 3.6 Die Strukturen der mittleren Ringverbindungen. XIV. Struktur des Silbernitrat-trans-Cyclodecen-Addukts. Helv. Chim. Acta 50 (1967): 2379-2386. [P. Ganis and J. D. Dunitz] 3.7 Die Kristallstruktur des 1,6-8,13-Bis-oxido-[14]-annulens. Helv. Chim. Acta 50 (1967): 2369-2378. [P. Ganis and J. D. Dunitz] 3.8 Structure of the K+ Complex with Nonactin, a Macrotetrolide Antibiotic Possessing Highly Specific K+ Transport Properties. J. Mol. Biology 30 (1967): 559-563. [B. T. Kilbourn, J. D. Dunitz, L. A. R. Pioda and W. Simon] 3.9 Lattice Parameters and Space Groups of some Aromatic Schiff Bases. Acta Crystallogr. B24 (1968): 463-464. [H. B. Bürgi, J. D. Dunitz and C. Züst] 3.10 Die Strukturen der mittleren Ringverbindungen. XV. 6-Ketononanolid (Oxacyclodeca-2,7-dion). Helv. Chim. Acta 51 (1968): 445-458. [W. Fedeli and J. D. Dunitz] 3.11 Conformation of the Bicyclo[2,2,2]octane System. Chem. Comm. (1968): 567-568. [O. Ermer and J. D. Dunitz] 3.12 Umordnung von Liganden an trigonal bipyramidalen Atomen. Angew. Chem. 80 (1968): 700-701. [J. D. Dunitz and V. Prelog]

English translation: Ligand Reorganization in the Trigonal Bipyramid. Angew. Chem. Int. Ed. Engl. 7, 725-726 (1968). [J. D. Dunitz and V. Prelog]

 3.13 Die Strukturen der mittleren Ringverbindungen. XVI. Cyclooctan-cis-1,2-dicarbonsäure. Helv. Chim. Acta 51 (1968): 1514-1526. [H. B. Bürgi and J. D. Dunitz] 3.14 Structure of the K+ Complex with Enniatin B, a Macrocyclic Antibiotic with K+ Transport Properties. J. Mol. Biology 42 (1969): 603-606. [M. Dobler, J. D. Dunitz and J. Krajewski] 3.15 Least-squares Refinement of Centrosymmetrical Trial Structures in Non-centrosymmetric Space Groups. A Warning. Acta Crystallogr. A26 (1970): 163. [O. Ermer and J. D. Dunitz] 3.16 Molecular Conformation of Benzylideneanilines; Relation to Electronic Structure and Spectra. Chem. Comm. (1969): 472-473. [H. B. Bürgi and J. D. Dunitz] 3.17 Langsame Inversion am pyramidal gebundenen Stickstoff: Kristallstrukturanalyse des trans-N-Methoxy-3,3-dimethoxycarbonyl-5-cyan-1,2-oxazolidins. Helv. Chim. Acta 52 (1969): 1831-1833. [M. Dobler, J. D. Dunitz and D. M. Hawley] 3.18 Zur Konformation des Bicyclo[2.2.2]octan Systems. Helv. Chim. Acta 52 (1969): 1861-1886. [O. Ermer and J. D. Dunitz] 3.19 Die Struktur des KNCS-Komplexes von Nonactin. Helv. Chim. Acta 52 (1969): 2573-2583. [M. Dobler, J. D. Dunitz and B. T. Kilbourn] 3.20 Conformations of Medium Rings. Pure and Applied Chemistry 25 (1971): 495-508 3.21 Conformations of Medium Rings. Izvjestaj Jugoslav. centr. krist. 4 (1969): 37-47 3.22 The two Forms of Cyclohexane. J. Chem. Ed. 47 (1970): 488-490 3.23 Multiple Solutions of Crystal Structures by Direct Methods. Acta Crystallogr. A27 (1971): 117-119. [H. B. Bürgi and J. D. Dunitz] 3.24 Experimental Determination of short Transannular H•••H Distances in a Cyclodecane Derivative. Chem. Comm. (1971): 178-179. [O. Ermer and J. D. Dunitz] 3.25 Crystallographic Studies of Synthetic Corrinoids. I. Nickel (II)-1,8,8,13,13-pentamethyl-5-cyano-trans-corrin Chloride. Helv. Chim. Acta 54 (1971): 77-89. [J. D. Dunitz and E. F. Meyer, Jr.] Crystallographic Studies of Synthetic Corrinoids. II. Molecular Structure of a C/D-seco-Corrinoid Nickel (II) Complex. Helv. Chim. Acta 54 (1971): 90-98. [M. Dobler and J. D. Dunitz] Crystallographic Studies of Synthetic Corrinoids. III. Structural Similarities and Differences between A/D-seco-Corrinoid Complexes of Divalent Nickel, Palladium and Platinum. Helv. Chim. Acta 54 (1971): 98-112. [M. Currie and J. D. Dunitz] 3.26 The Non-planar Amide Group. J. Mol. Biology 59 (1971): 169-182. [F. K. Winkler and J. D. Dunitz] 3.27 Molecular Conformation of Benzylideneanilines. Helv. Chim. Acta 54 (1971): 1255-1260. [H. B. Bürgi and J. D. Dunitz] 3.28 Crystal Structure of the Antibiotic Monensin. Similarities and Differences between Free Acid and Metal Complex. Helv. Chim. Acta 54 (1971): 1103-1108. [W. K. Lutz, F. K. Winkler and J. D. Dunitz] 3.29 The Planarity of the Equilateral, Isogonal Pentagon. Elemente der Mathematik 27 (1972): 25-32. [J. D. Dunitz and J. Waser] 3.30 Non-empirical SCF Calculations on Hydrogen-like Molecules: the Effect of Nuclear Charge on Binding Energy and Bond Length. Chem. Comm. (1972): 568-569. [J. D. Dunitz and T. K. Ha] 3.31 Approximate Relationships between Conformational Parameters in 5- and 6-Membered Rings. Tetrahedron 28 (1972): 5459-5467 3.32 Non-rigid-body Thermal-motion Analysis. Acta Crystallogr. A29 (1973): 93-94. [J. D. Dunitz and D. N. J. White] 3.33 A Complete Catalogue of Polyhedra with Eight or Fewer Vertices. Acta Crystallogr. A29 (1973): 362-371. [D. Britton and J. D. Dunitz] 3.34 Geometric Reaction Coordinates. II. Nucleophilic Addition to a Carbonyl Group. J. Amer. Chem. Soc. 95 (1973): 5065-5067. [H. B. Bürgi, J. D. Dunitz and E. Shefter] 3.35 Crystal Structure Analyses of 1,4,7,10,13,16-Hexaoxacyclooctadecane and its Complexes with Alkali Thiocyanates. Acta Crystallogr. B30 (1974): 2733-2738. [J. D. Dunitz, M. Dobler, P. Seiler and R. P. Phizackerley] 1,4,7,10,13,16-Hexaoxacyclooctadecane. Acta Crystallogr. B30 (1974): 2739-2741. [J. D. Dunitz and P. Seiler] Hydrated Sodium Thiocyanate Complex of 1,4,7,10,13,16-Hexaoxacyclooctadecane Acta Crystallogr. B30 (1974): 2741-2743. [M. Dobler, J. D. Dunitz and P. Seiler] Potassium Thiocyanate Complex of 1,4,7,10,13,16-Hexaoxacyclooctadecane. Acta Crystallogr. B30 (1974): 2744-2745. [P. Seiler, M. Dobler and J. D. Dunitz] Calcium Thiocyanate Complex of 1,4,7,10,13,16-Hexaoxacyclooctadecane. Acta Crystallogr. B30 (1974): 2750. [J. D. Dunitz and P. Seiler] 3.004 Publications by Jack Dunitz 1975-1978 31 folders 4.1 Non-bonded Interactions in Organic Molecules. In International Review of Science: Physical Chemistry, Series 2, Volume 11. 1975, pp. 81-120. [J. D. Dunitz and H. B. Bürgi] 4.2 Amide Group Deformation in Medium-ring Lactams. Acta Crystallogr. B31 (1975): 251-263. [J. D. Dunitz and F. K. Winkler] Medium-ring Compounds. XXVI. Tripelargolactam Oxonium Chloride. Acta Crystallogr. B31 (1975): 264-267. [F. K. Winkler and J. D. Dunitz] Medium-ring Compounds. XIX. Caprolactam: Structure Refinement. Acta. Crystallogr. B31 (1975): 268-269. [F. K. Winkler and J. D. Dunitz] Medium-ring Compounds. XX. Caprolactam Hydrochloride. Acta. Crystallogr. B31 (1975): 270-272. [ F. K. Winkler and J. D. Dunitz] Medium-ring Compounds. XXI. Enantholactam Hydrochloride. Acta. Crystallogr. B31 (1975): 273-275. [F. K. Winkler and J. D. Dunitz] Medium-ring Compounds. XXII. Caprylolactam. Acta. Crystallogr. B31 (1975): 276-278. [F. K. Winkler and J. D. Dunitz] Medium-ring Compounds. XXIII. Caprylolactam Hydrochloride. Acta. Crystallogr. B31 (1975): 278-281. [F. K. Winkler and J. D. Dunitz] Medium-ring Compounds. XXIV. Pelargolactam. Acta. Crystallogr. B31 (1975): 281-283. [F. K. Winkler and J. D. Dunitz] Medium-ring Compounds. XXV. Pelargolactam Hemihydrochloride. Acta. Crystallogr. B31 (1975): 283-286. [F. K. Winkler and J. D. Dunitz] Medium-ring Compounds. XXVII. Caprinolactam Hemihydrochloride. Acta. Crystallogr. B31 (1975): 286-288. [ F. K. Winkler and J. D. Dunitz] 4.3 Chemical Reaction Paths. V. The SN1 Reaction. J. Amer. Chem. Soc. 97 (1975): 921-922. [P. Murray-Rust, H. B. Bürgi and J. D. Dunitz] 4.4 On the Isomerization of Pentacoordinated Molecules. J. Amer. Chem. Soc. 97 (1975): 3836. [D. Britton and J. D. Dunitz] 4.5 Chemical Reaction Paths. Phil. Trans. R. Soc. Lond. B272 (1975): 99-108 4.6 Medium ring Compounds. XXVIII. 1,5-Diaza-6,10-cyclodecadione. Acta Crystallogr. B31 (1975): 1372-1377. [T. Srikrishnan and J. D. Dunitz] 4.7 Comparison of the Results of Two Independent Analyses of the Ethylchlorophyllide A Dihydrate Crystal Structure. Acta Crystallogr. B31 (1975): 1586-1589. [C. Kratky and J. D. Dunitz] 4.8 Structure of Hexaethylidenecyclohexane (hexamethyl-[6]radialene) by X-ray Analysis. Helv. Chim. Acta 58 (1975): 707-712. [W. Marsh and J. D. Dunitz] 4.9 Chemical Reaction Paths - VI. A Pericyclic Ring Closure. Tetrahedron 31 (1975): 3089-3092. [H. B. Bürgi, E. Shefter and J. D. Dunitz] 4.10 Incipient Nucleophilic Additions. I. 1-p-Tolyl-1-azacyclooctan-5-one. Acta Crystallogr. B31 (1975): 2912-2914. [M. Kaftory and J. D. Dunitz] Incipient Nucleophilic Additions. II. 11-Methyl-11-azabicyclo[5.3.1]undecan-4-one. Acta Crystallogr. B31 (1975): 2914-2916. [M. Kaftory and J. D. Dunitz] Incipient Nucleophilic Additions. III. 3-Oxa-9-methyl-9-azabicyclo[3.3.1]nonan-7-one. Acta Crystallogr. B31 (1975): 2917-2918. [M. Kaftory and J. D. Dunitz] Incipient Nucleophilic Additions. IV. 1,5-Dinitro-3-methyl-3-azabicyclo[3.3.1]nonan-7-one. Acta Crystallogr. B32 (1976): 1-4. [M. Kaftory and J. D. Dunitz] 4.11 2,10,11-Trioxatricyclo[4,4,4,01,6]tetradecane: a Stable Orthoester. Acta Crystallogr. B32 (1976): 318-320. [S. H. Banyard and J. D. Dunitz] 4.12 11,13-Dioxo-12-methyl-12-aza[4,4,3]propella-3,8-diene. Acta Crystallogr. B32 (1976): 617-619. [M. Kaftory and J. D. Dunitz] 4.13 syn-8,9-epoxy-11,13-dioxo-12-methyl-12-aza[4,4,3]propell-3-ene. Acta Crystallogr. B32 (1976): 619-622. [M. Kaftory, J. D. Dunitz and O. S. Mills] 4.14 Versuche zur Redox-Simulation der photochemischen A/D-Secocorrin -> Corrin - Cycloisomerisierung. Elektrochemische Oxidation von Nickel (II)-1-methyliden-2,2,7,7,12,12-hexamethyl-15-cyan-1,19-seco-corrinat-perchlorat. Helv. Chim. Acta 59 (1976): 924-937. [B. Kräutler, A. Pfaltz, R. Nordmann, K. O. Hodgson, J. D. Dunitz and A. Eschenmoser] 4.15 Medium Ring Compounds. XXIX. Cyclooctane-1,5-dione-dioxime. Helv. Chim. Acta 59 (1976): 1417-1423. [F. K. Winkler, P. Seiler, J. P. Chesick and J. D. Dunitz] 4.16 Crystallographic Studies of Synthetic Corrinoids IV. Molecular Structure of a Ni(II)Oxaporphyrinoid. From Electrochemical Oxidation of a Ni(II)Seco-Corrin. Helv. Chim. Acta 59 (1976): 1898-1904. [K. O. Hodgson and J. D. Dunitz] 4.17 Gerhard Schmidt (1919 - 1971) and the Road to Chemical Crystallography. Monographs in Modern Chem. 8 (1976): 255-269 4.18 Ordered Aggregation Satates of Chlorophyll A and some Derivatives. J. Mol. Biol. 113 (1977): 431-442. [C. Kratky and J. D. Dunitz] 4.19 Methylchlorophyllide A Dihydrate. Acta Crystallogr. B33 (1977): 545-547. [C. Kratky and J. D. Dunitz] 4.20 Methylpyrochlorophyllide A Monohydrate Monoetherate. Acta Crystallogr. B33 (1977): 547-549. [C. Kratky, H. P. Isenring and J. D. Dunitz] 4.21 Directional Preferences of Nonbonded Atomic Contacts with Divalent Sulfur. I. Electrophiles and Nucleophiles. J. Amer. Chem. Soc. 99 (1977): 4860-4862. [Richard E. Rosenfield, Jr., R. Parthasarathy and J. D. Dunitz] 4.22 1,4,9,12-Tetraoxadispiro[4.2.4.2]tetradecane. Acta Crystallogr. B33 (1977): 1643-1645. [D. J. Chadwick, J. D. Dunitz and W. B. Schweizer] 4.23 1-Carboxy-trans-bicyclo[4.4.0]decan-3-one Ethylene Acetal {trans-Hexahydrospiro [1,3-dioxolane-2,2'(1'H)-naphthalene]-8'a(3'H)-carboxylic Acid}. Acta Crystallogr. B34 (1978): 965-968. [D. J. Chadwick and J. D. Dunitz] 4.24 Elimination of Extinction with a Temperature Gradient. Acta Crystallogr. A34 (1978): 329-336. [P. Seiler and J. D. Dunitz] 4.25 Distortions of MX4 Molecules from Td Symmetry; I. Kernel, Cokernel and Averaged Configurations. Acta Crystallogr. B34 (1978): 1787-1793. [P. Murray-Rust, H. B. Bürgi and J. D. Dunitz] 4.26 Distortions of MX4 Molecules from Td Symmetry; Analysis of PO4, SO4, and AlCl4 Species. Acta Crystallogr. B34 (1978): 1793-1803. [P. Murray-Rust, H. B. Bürgi and J. D. Dunitz] 4.27 A Test for Rigid-body Vibrations, based on a Generalization of Hirshfeld's "Rigid-Bond" Postulate. Acta Crystallogr. A34 (1978): 828-829. [R. E. Rosenfield, Jr., K. N. Trueblood and J. D. Dunitz] 4.28 Regioselective, Stereoselective Reduction of gem-Disubstituted Succinimides: Steric Hindrance along the Preferred Reaction Path. Helv. Chim. Acta 61 (1978): 2176-2189. [R. E. Rosenfield. Jr. and J. D. Dunitz] 4.29 Low-temperature Refinement of the Structure of 11-Methyl-11-azabicyclo[5.3.1] undecan-4-one. Acta Crystallogr. B34 (1978): 3245-3248. [E. Bye and J. D. Dunitz] 4.30 Nucleophilic Addition to a Triple Bond; Preliminary ab initio Study. Helv. Chim. Acta 61 (1978): 2538-2541. [O. Eisenstein, G. Procter and J. D. Dunitz] 4.31 Structural Studies of 1,8-Disubstituted Naphthalenes as Probes for Nucleophile - Electrophile Interactions. Helv. Chim. Acta 61 (1978): 2783-2808. [W. B. Schweizer, G. Procter, M. Kaftory and J. D. Dunitz] 3.005 Publications by Jack Dunitz 1979-1982 33 folders 5.1 Crystallographic and Spectroscopic Study of the Keto-acid-Hydroxy-lac-tone Isomerization Path. J. Chem. Soc. Perkin Transactions II (1979): 276-284. [D. J. Chadwick and J. D. Dunitz] 5.2 A New Interpretation of the Disordered Crystal Structure of Ferrocene. Acta Crystallogr. B35 (1979): 1068-1074. [P. Seiler and J. D. Dunitz] 5.3 Description of Molecular Distortions in Terms of Symmetry Coordinates. Acta Crystallogr. A35 (1979): 703-713. [P. Murray-Rust, H. B. Bürgi and J. D. Dunitz] 5.4 The Structure of Triclinic Ferocene at 101, 123 and 148 K. Acta Crystallogr. B35 (1979): 2020-2032. [P. Seiler and J. D. Dunitz] 5.5 Crystal Structure of a Double Helicene, Diphenanthro-[4,3-a; 3',4'-o]Picene. Bull. Soc. Chim. Belg. 88 (1979): 847-852. [W. Marsh and J. D. Dunitz] 5.6 Kristallstruktur von 2-Lithium-2-methyl-1,3-dithian. TMEDA. Angew.Chem. 92 (1980): 59-60. [R. Amstutz, D. Seebach, P. Seiler, B. Schweizer and J. D. Dunitz] English translation: Crystal Structure of 2-Lithium-2-methyl-1,3-dithiane. TMEDA. Angew. Chem. Int. Ed. Engl. 19 (1980): 53-54. [R. Amstutz, D. Seebach, P. Seiler, B. Schweizer and J. D. Dunitz] 5.7 1,4,7,10,13,16-Hexaoxacyclooctadecane: Crystal Structure at 100 K. Acta Crystallogr. B36 (1980): 615-620. [E. Maverick, P. Seiler, W. B. Schweizer and J. D. Dunitz] 5.8 Potential Energy Surface of BH4- and Molecular Deformations Induced by an External Cation. Israel J. Chem. 19 (1980): 292-298. [O. Eisenstein and J. D. Dunitz] 5.9 Synthesis, Properties, and Crystal Structure of Silylnitronates: Towards the SN2 Reaction Path with Retention of Configuration at Silicon. Helv. Chim. Acta 63 (1980): 697-710. [E. W. Colvin, A. K. Beck, B. Bastani, D. Seebach, Y. Kai and J. D. Dunitz] 5.10 Directional Preferences of Approach of Nucleophiles to Sulfonium Ions. Helv. Chim. Acta 63 (1980): 1068-1073. [D. Britton and J. D. Dunitz] 5.11 Struktur eines O,N-Ketenacetals: (1RS, 8SR, 10SR, 4(15)Z)-4-Äthyliden-5-oxa-3-azatricyclo[8.4.0.03,8]tetradecan). Helv. Chim. Acta 63 (1980): 1158-1175. [A. Kümin, E. Maverick, P. Seiler, N. Vanier, L. Damm, R. Hobi, J. D. Dunitz and A. Eschenmoser] 5.12 Redetermination of the Ruthenocene Structure at Room Temperature and at 101 K: Molecular Internal Motion. Acta Crystallogr. B36 (1980): 2946-2950. [P. Seiler and J. D. Dunitz] 5.13 Planar tetrakoordiniertes Silicium? - Eine Kritik. Angew. Chem. 92 (1980): 1070-1071

English translation: Planar Four-Coordinates Silicon? Angew. Chem. Int. Ed. Engl. 19 (1980): 1034.

 5.14 Mapping Chemical Reaction Pathways: An Experimental Approach. In Molecular Structure and Dynamics. Ed. M. Balaban. Internat. Science Services, 1980, pp. 103-128 5.15 Recognition and Use of Systematically Aberrant Phase Relationships. Acta Crystallogr. A37 (1981): 131-132. [D. Britton and J. D. Dunitz] 5.16 Crystal Structures of 8-Methoxy- and 8-Nitronaphthonitrile; Intramolecular Nucleophile-electrophile Interactions. Helv. Chim. Acta 64 (1981): 471-477. [G. Procter, D. Britton and J. D. Dunitz] 5.17 Organic Chemistry, X-ray Analysis and Dorothy Hodgkin. In Structural Studies on Molecules of Biological Interest, a Volume in Honour of Professor Dorothy Hodgkin. Ed. G. Dodson, J. P. Glusker and D. Sayre. Oxford: Clarendon Press, 1981, pp. 47-59 5.18 Chemical Reaction Paths 7. Pathways for SN2 and SN3 Substitution at Sn(IV). J. Amer. Chem. Soc. 103 (1981): 2971-2979. [D. Britton and J. D. Dunitz] 5.19 Kristallstruktur von 2-Lithio-2-phenyl-1,3-dithian-Tetrahydrofuran-Tetramethyl-ethylendiamin (1/1/1); "X - X" - Electronendichteverteilung in Lithio-methyl- und Lithio-phenyl-dithian. Angew. Chem. 93 (1981): 487-488. [R. Amstutz, J. D. Dunitz and D. Seebach] English translation: Crystal Structure of 2-Lithio-2-phenyl-1,3-dithiane-Tetrahydrofuran-Tetramethyl-ethylenediamine (1/1/1); Electron-Density Difference Maps for Lithio-methyl- and Lithio-phenyl-dithiane. Angew. Chem. Int. Ed. Engl. 20 (1981): 465-466. [R. Amstutz, J. D. Dunitz and D. Seebach] 5.20 Experimental Evidence for the Absence of Bonding Electron Density between Inverted Carbon Atoms. J. Amer. Chem. Soc. 103 (1981): 7378-7380. [P. Chakrabarti, P. Seiler, J. D. Dunitz, A. -D. Schlüter and G. Szeimies] 5.21 Correct Structure of a Condensation Product C6H12N4O4 from Hydrazine, Formaldehyde and Hydrogen Peroxide. Helv. Chim. Acta 64 (1981): 2614-2616. [S. N. Whittleton, P. Seiler and J. D. Dunitz] 5.22 Tetrameric Cubic Structures of Two Solvated Lithium Enolates. Helv. Chim. Acta 64 (1981): 2617-2621. [R. Amstutz, W. B. Schweizer, D. Seebach and J. D. Dunitz] 5.23 Mechanistic Implications of the Tetrameric Cubic Structure of Lithium Enolates. Helv. Chim. Acta 64 (1981): 2622-2626. [D. Seebach, R. Amstutz and J. D. Dunitz] 5.24 Crystallographic and Spectroscopic Evidence for an Intramolecular (OH•••π)-Interaction. Helv. Chim. Acta 64 (1981): 2738-2740. [W. B. Schweizer, J. D. Dunitz, R. A. Pfund, G. M. Ramos Tombo and C. Ganter] 5.25 Structure, Synthesis, and Properties of Some Persubstituted 1,2-Dinitroethanes. In Quest of Nitrocyclopropyl-Anion Derivatives. Helv. Chim. Acta 65 (1982): 137-161. [Y. Kai, P. Knochel, S. Kwiatowski, J. D. Dunitz, J. F. M. Oth and D. Seebach] 5.26 Structure of 13-Methyl-2,1-dioxatricyclo[4.4.4.01,6]tetradecane at 96 K. Acta Crystallogr. B38, 1241-1245 (1982). [K. L. Brown, G. J. Down, J. D. Dunitz and P. Seiler] 5.27 Low-Temperature Crystallization of Orthorhombic Ferrocene: Structure Analysis at 98K. Acta Crystallogr. B38 (1982): 1741-1745. [P. Seiler and J. D. Dunitz] 5.28 4,5-Dimethyl-9,10-diazaphenanthrene N,N'-Dioxide. Acta Crystallogr. B38 (1982): 2052-2053. [S. N. Whittleton and J. D. Dunitz] 5.29 4,5-Dichloro-9,10-diazaphenanthrene N,N'-Dioxide. Acta Crystallogr. B38 (1982): 2053-2055. [S. N. Whittleton and J. D. Dunitz] 5.30 Temperature Dependence of Thermal Motion in Crystalline Naphthalene. Acta. Crystallogr. B38 (1982): 2218-2228. [C. P. Brock and J. D. Dunitz] 5.31 Directional Preferences of Ether O-Atoms towards Alkali and Alkaline Earth Cations. Helv. Chim. Acta 65 (1982): 1482-1488. [P. Chakrabarti and J. D. Dunitz] 5.32 Structural Characteristics of the Carboxylic Amide Group. Helv. Chim. Acta 65 (1982): 1555-1562. [P. Chakrabarti and J. D. Dunitz] 5.33 Chemical Reaction Paths. VIII. Stereoisomerization Path for Triphenylphosphine Oxide and Related Molecules: Indirect Observation of the Structure of the Transition State. J. Amer. Chem. Soc. 104 (1982): 5893-5898. [E. Bye, W. B. Schweizer and J. D. Dunitz] 3.006 Publications by Jack Dunitz 1983-1987 37 folders 6.1 Internal Molecular Motions in Crystals. The Estimation of Force Constants, Frequencies and Barriers from Diffraction Data. A Feasibility Study. Acta Cryst. B39 (1983): 120-133. [K. N. Trueblood and J. D. Dunitz] 6.2 X-Ray Study of the Deformation Density in Tetrafluoroterephthalodinitrile: Weak Bonding Density in the C, F-Bond. Helv. Chim. Acta 66 (1983): 123-133. [J. D. Dunitz, W. B. Schweizer and P. Seiler] 6.3 Crystal Structure of 1,1,4,4,-Tetrafluorocyclohexane at 95 K. Helv. Chim. Acta 66 (1983): 134-137. [J. D. Dunitz, W. B. Schweizer and P. Seiler] 6.4 From Crystal Statics to Chemical Dynamics. Accounts of Chemical Research 16 (1983): 153-161. [H. B. Bürgi and J. D. Dunitz] 6.5 An All-nitrogen Aromatic Ring System: Structural Study of 4-Dimethylaminophenylpentazole. J. Chem. Soc., Chem. Comm. (1983): 910-911. [J. D. Wallis and J. D. Dunitz] 6.6 The Absence of Bonding Electron Density in Certain Covalent Bonds as Revealed by X-ray Analysis. J. Amer. Chem. Soc. 105 (1983): 7056-7058. [J. D. Dunitz and P. Seiler] 6.7 Electron Distributions and the Chemical Bond. (Book Review) Angew. Chemie 95 (1983): 759

Reprinted in Angew. Chemie Int. Ed. Engl., 23, 86 (1984)

 6.8 Interactions between Functional Groups. I. Crystal Structure of 2-Phenylethynyl-N,N-dimethylaniline at 98 K: A Remarkably Short C-H•••C Distance. Helv. Chim. Acta 67 (1984): 39-46. [J. D. Wallis and J. D. Dunitz] 6.9 Further Investigation of the Nature of the C-Li Bond. Structures of a Phenylthiomethyllithium Complex and of a Methylthiomethyllithium Complex. Helv. Chim. Acta 67 (1984): 224-236. [R. Amstutz, T. Laube, W. B. Schweizer, D. Seebach and J. D. Dunitz] 6.10 Incipient Nucleophilic Attack on a Nitrogen-Nitrogen Triple Bond: Crystal Structure of Quinoline-8-diazonium-1-oxide tetrafluroborate at 95 K. J. Chem. Soc.: Chem. Comm. (1984): 671-672. [J. D. Wallis and J. D. Dunitz] 6.11 Can X-ray Diffraction Distinguish between Protium and Deuterium Atoms? Nature 309 (1984): 435-438. [P. Seiler, B. Martinoni and J. D. Dunitz] 6.12 Parameter Refinement for Tetrafluoroterephthalonitrile at 98 K: Making the Best of a Bad Job. Acta Crystallogr. B40 (1984): 319-327. [P. Seiler, W. B. Schweizer and J. D. Dunitz] 6.13 Interactions between Functional Groups. II. Structure of the 2-Dimethylaminobenzenediazonium Cation: Retention of Planarity Despite Excessive Steric Crowding. Helv. Chim. Acta 67 (1984): 1374-1378. [J. D. Wallis and J. D. Dunitz] 6.14 Crystal and Molecular Structure of 1-Lithio-3,6-diethoxy-2,5-dimethyl-1,2-dihydropyrazine, the Lithiated Bis-lactim Ether of the Diketopiperazine from Alanine. J. Chem. Soc., Chem. Comm. (1984): 853-854. [D. Seebach, W. Bauer, J. Hansen, T. Laube, W. B. Schweizer and J. D. Dunitz] 6.15 Stereochimica. In Enciclopedia del Novecento, Volume VII. 1984, pp. 162-172 6.16 From Crystal Statics Towards Molecular Dynamics. Trans. Amer. Cryst. Assn. 20 (1984): 1-13 6.17 Electron Density Distribution in the Organic Superconductor (TMTSF)2AsF6: Fact and Fancy. Science 228 (1985): 353-354 6.18 Über die Wechselwirkung zwischen Lithium-Enolaten und sekundären Aminen in Lösung und im Kristall. Helv. Chim. Acta 68 (1985): 1373-1393. [T. Laube, J. D. Dunitz and D. Seebach] 6.19 Detection of Radiation Damage in Organic Crystals. Aust. J. Phys. 38 (1985): 405-411. [P. Seiler and J. D. Dunitz] 6.20 Structures of Three Lithium Ester Enolates by X-ray Diffraction: Derivation of Reaction Path for Cleavage into Ketene and Alcoholate. J. Amer. Chem. Soc. 107 (1985): 5403-5409. [D. Seebach, R. Amstutz, T. Laube, W. B. Schweizer and J. D. Dunitz] 6.21 Internal Molecular Motion as Forerunner of a Phase Change Involving Conformational Isomerization. J. Amer. Chem. Soc. 107 (1985): 5535-5537. [Q. C. Yang, M. F. Richardson and J. D. Dunitz] 6.22 Internal Molecular Motion of Triphenylphosphine Oxide: Analysis of Atomic Displacement Parameters for Orthorhombic and Monoclinic Crystal Modifications at 100 and 150 K. J. Amer. Chem. Soc. 107 (1985): 6964-6970. [C. P. Brock, W. B. Schweizer and J. D. Dunitz] 6.23 X-ray Diffraction Study of 2-Aminopropenenitrile at 97 K. Helv. Chim. Acta 68 (1985): 2093-2099. [P. Seiler and J. D. Dunitz] 6.24 Lone-Pair Directionality in Hydrogen Bond Potential Functions for Molecular Mechanics Calculations: The Inhibition of Human Carbonic Anhydrase II by Sulfonamides. J. Amer. Chem. Soc. 107 (1985): 7653-7658. [A. Vedani and J. D. Dunitz] 6.25 Chiral Metals? A Chiral Substrate for Organic Conductors and Superconductors. Helv. Chim. Acta 69 (1986): 69-70. [J. D. Wallis, A. Karrer and J. D. Dunitz] 6.26 Die Geometrie von Lithium-Komplexen mit koordinative gebundenen Carbonylverbindungen und die Struktur eines Lithiumdienolates. Chem. Ber. 119 (1986): 434-443. [R. Amstutz, J. D. Dunitz, T. Laube, W. B. Schweizer and D. Seebach] 6.27 Interactions between Functional Groups. III. The Structure of N,N-Dimethylamino-8-nitro-1-naphthaleneamine in Seven Crystalline Environments. Helv. Chim. Acta 69 (1986): 255-266. [M. Egli, J. D. Wallis and J. D. Dunitz] 6.28 Are Ionic Solids Really Built of Ions? New Evidence from X-ray Diffraction. Helv. Chim. Acta 69 (1986): 1107-1112. [P. Seiler and J. D. Dunitz] 6.29 Body Temperature and the Specific Heat of Water. Nature 324 (1986): 418. [J. D. Dunitz and S. A. Benner] 6.30 An Empirical Potential Function for Metal Centers: Application to Molecular Mechanics Calculations on Metalloproteins. J. Comput. Chem. 6 (1986): 701-710. [A. Vedani, M. Dobler and J. D. Dunitz] 6.31 β-Propiolactam (1-Aza-2-cyclobutanone) at 170 K. Acta Crystallogr. C43 (1987): 565-567. [Q. C. Yang, P. Seiler and J. D. Dunitz] 6.32 Fractional Bonds: Relations among Their Lengths, Strengths and Stretching Force Constants. J. Amer. Chem. Soc. 108 (1987): 2924-2926. [H. B. Bürgi and J. D. Dunitz] 6.33 Are (TSeT)2I Crystals Homochiral or Microtwinned? Acta Crystallogr. A43 (1987): 430-431. [A. Karrer and J. D. Dunitz] 6.34 Structures and Electrical Properties of some New Organic Conductors Derived from the Donor Molecule TMET (S,S,S,S-Bis(dimethylethylenedithio)tetrathiafulvalene. Helv. Chim. Acta 70 (1987): 942-953. [A. Karrer, J. D. Wallis, J. D. Dunitz, B. Hilti, C. W. Mayer, M. Bürkle and J. Pfeiffer] 6.35 Eine Csp3-gebundene Methylgruppe in ekliptischer Konformation; experimenteller und theoretischer Nachweis von C-H•••O Wasserstoffbrücken. Angew. Chem. 99 (1987): 1216-1218. [P. Seiler, G. R. Weisman, E. D. Glendening, F. Weinhold, V. B. Johnson and J. D. Dunitz] English translation: Observation of an Eclipsed Csp3-CH3 Bond in a Tricyclic orthoamide; Experimental and Theoretical Evidence for C-H•••O Hydrogen Bonds. Angew. Chem. Int. Ed. Engl. 26 (1987): 1175-1177. [P. Seiler, G. R. Weisman, E. D. Glendening, F. Weinhold, V. B. Johnson and J. D. Dunitz] 6.36 Rotation Barriers in Crystals from Atomic Displacement Parameters. Molecular Physics 62 (1987): 451-459. [E. Maverick and J. D. Dunitz] 6.37 Electron Density Maps. In Patterson and Pattersons. Ed. J. P. Glusker, B. K. Patterson and M. Rossi. Oxford Univ. Press, 1987, pp. 222-251 3.007 Publications by Jack Dunitz 1988-1995 29 folders 7.1 Is Accurate X-Ray Analysis Worthwhile? Bull. Chem. Soc. Jpn. 61 (1988): 1-11 7.2 Interpretation of Atomic Displacement Parameters from Diffraction Studies. J. Phys. Chem. 92 (1988): 856-867. [J. D. Dunitz, V. Schomaker and K. N. Trueblood] 7.3 Gleichgewichtsstruktur, stabilisierter Uebergangszustand oder Fehlordnung im Kristall? Tieftemperatur-Kristallstukturanalysen der antiaromatischen Systeme Tetra-tert-butyl-s-indacen und Tetra-tert-butylcyclobutadien. Angew. Chem. 100 (1988): 415-418. [J. D. Dunitz, C. Krüger, H. Irngartinger, E. F. Maverick, Y. Wang and M. Nixdorf]

English translation: Equilibrium Structure, Stabilized Transition State, or Disorder in the Crystal? Studies of the Antiaromatic Systems Tetra-tert-butyl-s-indacene and Tetra-tert-butyl-cyclobutadiene by Low-Temperature Crystal Structure Analysis. Angew. Chem. Int. Ed. Engl. 27 (1988): 387-389. [J. D. Dunitz, C. Krüger, H. Irngartinger, E. F. Maverick, Y. Wang and M. Nixdorf].

 7.4 The Interpretation of Atomic Displacement Parameters. Mol. Cryst. Liq. Cryst. Inc. Nonlin. Opt. 156 (1988): 11-24 7.5 A Pseudo-centrosymmetric Chiral Crystal Structure: (5S,6S)-5,6-Dihydro-5,6-dimethyl-1,3-dithiolo[4,5-b][1,4]dithiin-2-thione. Acta Crystallogr. C44 (1988): 1037-1039. [J. D. Wallis and J. D. Dunitz] 7.6 Electron Density Distributions in Covalent and Ionic Bonds. In Molecular Structure: Chemical Reactivity and Biological Activity. Ed. J. J. Stezowski, J.-L. Huang and M.-C. Shao. Oxford Univ. Press, 1988, pp.242-248 7.7 Atombewegungen in Molekülkristallen aus Beugungsmessungen. Angew. Chem. 100 (1988): 910-926. [J. D. Dunitz, E. F. Maverick and K. N. Trueblood]

Atomic Motions in Molecular Crystals from Diffraction Measurements. Angew. Chem. Int. Ed. Engl. 27 (1988): 880-895. [J. D. Dunitz, E. F. Maverick and K. N. Trueblood].

 7.8 Crystal Structures of Two Simple N-Substituted Dihydronicotinamides: Possible Implications for Stereoelectronic Arguments in Enzymology. J. Amer. Chem. Soc. 110 (1988): 5152-5157. [A. Glasfeld, P. Zbinden, M. Dobler, S. A. Benner and J. D. Dunitz] 7.9 Can Statistical Analysis of Structural Parameters from Different Crystal Structures Lead to Quantitative Energy Relationships? Acta Crystallogr. B44 (1988): 445-448. [H. B. Bürgi and J. D. Dunitz] 7.10 Conformational Polymorphism of Dimethyl 3,6-Dichloro-2,5-dihydroxyterephthalate. I. Structures and Atomic Displacement Parameters between 100 and 350 K for Three Crystal Forms. Acta Crystallogr. B45 (1989): 312-323. [Q. C. Yang, M. F. Richardson and J. D. Dunitz] 7.11 An Eclipsed C(sp3)-CH3 Bond in a Crystalline Hydrated Tricyclic Orthoamide: Evidence for C-H•••O Hydrogen Bonds. Helv. Chem. Acta 72 (1989): 1125-1135. [P. Seiler and J. D. Dunitz] 7.12 Medium-Ring Compounds. 30. cis-1,6-Cyclodecanediol: Molecular Compounds with the trans Isomer and with Itself. Israel J. Chem. 29 (1989): 137-142. [O. Ermer, B. R. Vincent and J. D. Dunitz] 7.13 Calculated Reaction Paths for a Solid-State Reaction: Racemization of Chiral Crystalline Cobaloxime Complexes by Exposure to X-Rays. Acta Crystallogr. B46 (1990): 45-54. [A. Uchida and J. D. Dunitz] 7.14 Distance Geometry and Molecular Conformation. (Book Review) J. Comp. Chem. 11 (1990): 265-266 7.15 How Good Are Quartic Functions to Describe Double-Minimum Energy Profiles? Nitrogen Inversion as Example. Helv. Chim. Acta 73 (1990): 583-593. [T. K. Ha and J. D. Dunitz] 7.16 Stereoelectronic Aspects of the Anomeric Effect in Fluoromethylamine. Helv. Chim. Acta 73 (1990): 1805-1817. [J. J. Irwin, T. K. Ha and J. D. Dunitz] 7.17 Phase Transitions in Molecular Crystals from a Chemical Viewpoint. Pure & Appl. Chem. 63 (1991): 177-185 7.18 Accurate Molecular Structures, their Determination and Importance. (Book Review) Acta Crystallographica B49 (1993): 145-146 7.19 Structural Chemistry in Helvetica Chimica Acta 1917-1992. Helv. Chim. Acta 76 (1993): 1115-1166. [H. B. Bürgi and J. D. Dunitz] 7.20 Interactions between Functional Groups. Part IV. The Responses of Four Diazonium Groups to Adjacent Electron-Rich Atoms in Peri-Substituted Naphthalene and Quinoline Derivatives. Helv. Chim. Acta 76 (1993): 1411-1424. [J. D. Wallis, R. J. C. Easton and J. D. Dunitz] 7.21 A. I. Kitaigorodsky: Personal Reminiscences. Acta Chemica Hungarica - Models in Chemistry 130 (1993): 153-157 7.22 Forty years of Ferrocene. In Organic Chemistry: Its Language and Its State of the Art. Ed. M. V. Kisakürek. Basel: Verlag HCA, 1993, pp. 9-24 7.23 The Entropic Cost of Bound Water in Crystals and Biomolecules. Science 264 (1994): 670 7.24 Disappearing Polymorphs. Acc. Chem. Res. 28 (1995): 193-200 7.25 Right and Left in Chiral Crystals. Acta Crystallographica A51 (1995): 588 7.26 Phase Changes and Chemical Reactions in Molecular Crystals. Acta Crystallographica B51 (1995): 619-631 7.27 Anhydrous DL-Glutamic Acid. Acta Crystallographica C51 (1995): 1377-1379 7.28 Scientific research - panacea or Pandora's Box. European Review 3 (1995): 295-301 7.29 Win some, lose some: enthalpy-entropy compensation in weak intermolecular interactions. Chemistry and Biology 2 (1995): 709-712 3.008 Publications by Jack Dunitz 1996-2004 31 folders 8.1 Thoughts on Crystals as Supermolecules. In The Crystal as a Supramolecular Entity. Ed. G. R. Desiraju. John Wiley & Sons, 1996, pp. 1-30 8.2 A New Textual Analysis of the Prelog Erlkönig Legent; an Interdisciplinary Approach to Scientific History and Literary Criticism. Croatica Chemica Acta 69 (1996): 409-415. [E. Heilbronner and J. D. Dunitz]

Reprinted in Helvetica Chimica Acta 79 (1996): 1241-1248.

 8.3 Force of nature: The life of Linus Pauling. (Book review) Protein Science 5 (1996): 2136-2138 8.4 Atomic Displacement Parameters Nomenclature: Report of a Subcommittee on Atomic Displacement Parameter Nomenclature. Acta Cryst. A52 (1996): 770-781. [K. N. Trueblood, H. B. Bürgi, H. Burzlaff, J. D. Dunitz, C. M. Grammacioli, H. H. Schulz, U. Shmueli and S. C. Abrahams] 8.5 Even-odd carbon atom disparity. Nature (Lond.) 384 (1996): 320. [J. A. R. P. Sarma, A. Nangla, G. R. Desiraju, E. Zass and J. D. Dunitz] 8.6 Symmetry Arguments in Chemistry. Proc. Natl. Acad. Sc. USA 93 (1996): 14260-14266 8.7 Dorothy Crowfoot Hodgkin - an introduction to her work and personality. In The Collected Works of Dorothy Crowfoot Hodgkin. Bangalore: Indian Institute of Sciences, 1996, pp vii-x.

Reprinted in Current Science 72 (1997): 447.

 8.8 Letter to the Editor. International Union of Crystallography Newsletter, 4, 3 (1996): 4. 8.9 Organic Fluorine Hardly Ever Accepts Hydrogen Bonds. Chem. Eur. J. 3 (1997): 83. [J. D. Dunitz and R. Taylor] 8.10 Chemical Crystallography - Past, present and future. Current Science 72 (1997): 468 8.11 Recollections of pre-prebiotic Leslie Orgel. Orig. Life Evol. Biosphere 27 (1997): 421 8.12 Vladimir Prelog (1906-1998): Pioneer of Stereochemistry. Nature, Lond. 391 (1998): 542 8.13 A Supramolecular Three-Dimensional Hydrogen-Bonded Network with Potential Application in Crystal Engineering Paradigms. Chem. Eur. J. 4 (1998): 745 8.14 Sum of Bond Angles on C Atoms. Chemical Intelligencer 6 (1998): 53 8.15 New Light on an Old Story: The Solid-State Transformation of Ammonium Cyanate into Urea. J. Am. Chem. Soc. 120, 50 (1998): 13274-13275. [J. D. Dunitz, K. D. M. Harris, R. L. Johnston, B. M. Kariuki, E. J. MacLean, K. Psallidas, W. B. Schweizer and R. R. Tykwinski] 8.16 Introductory and Concluding Remarks to a Symposium "Are Crystal Structures Predictable?" Nova Acta Leopoldina NF 79, Nr. 310 (1999): 9, 103-105 8.17 Into the New Millennium: the Present and Future of Crystal Structure Analysis. In Implications of Molecular and Materials Structure for New Technologies. Ed. J. A. K. Howard, F. H. Allen and G. P. Shields. Dordrecht, Kluwer Academic Publishers, 1999, pp. 1-9 8.18 Weak Interactions in Molecular Crystals. In Implications of Molecular and Materials Structure for New Technologies. Ed. J. A. K. Howard, F. H. Allen and G. P. Shields. Dordrecht: Kluwer Academic Publishers, 1999, pp. 175-184 8.19 Attractions and Repulsions in Molecular Crystals: What can be Learned from the Crystal Structures of Condensed Ring Aromatic Compounds? Acc. Chem. Res. 32 (1999): 677-684. [J. D. Dunitz and Angelo Gavezzotti] 8.20 The self-made tapestry: Pattern formation in nature. (Book review) Acta Cryst. B55 (1999): 810 8.21 A curiously short carbon-carbon double bond? Chem. Comm. (1999): 2547 8.22 Don't get your helix in a twist. Chemistry in Britain (July 2000): 22 8.23 The Even/Odd Disparity in Organic Compounds. Helv. Chim. Acta 83 (2000): 1-15. [G. R. Desiraju, J. D. Dunitz, A. Nangia, J. A. R. P. Sarma and E. Zass] 8.24 Space Filling in Molecular Solids. In Space or Spaces as Paradigms of Mental Categories: Proceedings of the VIII International Conference. Milan: Fondazione Carlo Erba, 2002, pp. 101-119 8.25 A test of crystal structure prediction of small organic molecules. Acta Cryst. B56 (2000): 697-714. [J. P. M. Lommerse, W. D. S. Motherwell, H. L. Ammon, J. D. Dunitz, A. Gavezzotti, D. W. M. Hofmann, F. J. J. Leusen, W. T. M. Mooij, S. L. Price, B. Schweizer, M. U. Schmidt, B. P. van Eijck, P. Verwer and D. E. Williams] 8.26 A Statistical Study of Density and Packing Variations among Crystalline Isomers. Tetrahedron 56 (2000): 6595-6601. [J. D. Dunitz. G. Filippini and A. Gavezzotti] 8.27 Molecular Shape and Crystal Packing: a Study of C12H12 Isomers, Real and Imaginary. Helv. Chim. Acta 83 (2000): 2317-2335. [J. D. Dunitz. G. Filippini and A. Gavezzotti] 8.28 Space filling in molecular crystals. In Symmetry 2000. I. Hargittai and T. C. Laurent, eds. Wenner-Gren International Series, Vol. 80. London: Portland Press, 2002, pp. 161-172 8.29 Crystallography: a Great Past, an Uncertain Future. Z. Kristallographie 217 (2002): 299-300 8.30 Molecular Shape and Intermolecular Liaison: Hydrocarbons and Fluorocarbons. Helv. Chem. Act. 86 (2003): 4073-4092 8.31 Organic Fluorine: Odd Man Out. ChemBioChem 5 (2004): 614-621 4 Manuscripts and Lecture Materials 1946-2006 undated 7 boxes

4.001 Manuscripts of Articles by Jack Dunitz 1946-1991 30 folders

This series contains a diverse collection of manuscripts and lecture materials, including a number of transparencies, drawings for slides and other visual aids created by Dunitz for use in presentation. Included in this series are several pieces written by Dunitz on the life and work of notable scientists, including Linus Pauling, John Monteath Robertson and Vladimir Prelog.

 1.1 Typescripts: "Verse" 1946-1952 1990

Series of poems, some of them parodies of other works, written by Dunitz. Titles include The Research Student's Lament, Our Worlds Came in Collision, Lines Addressed to Dr. Orgel and Of Molecules and Men.

 1.2 Typescript: The Tragicall Comedie of Dr. Faustus. Or "Scientia vincit omnia." Stage play written by J. D. Dunitz and C. E. Harrold. ["vaguely adapted from the 'Faustus' play of Christopher Marlow, esq."] Composed for the Caltech-Biology Biology Christmas party 1950 1.3 Typescript, Correspondence, Referee's Report: Electronic Structure of Metal Bis-Cyclopentadienyls, by Jack Dunitz and Leslie Orgel March 1953 1.4 Typescript, Notes, Correspondence: The Crystal Structure of Ferrocene, by Jack Dunitz, Leslie Orgel and Alexander Rich 1954-1955 1.5 Manuscript, Correspondence, Referee's Report: Stereochemistry of Cupric Compounds 1956-1957 1.6 Typescript: Crystals 1957 1.7 Manuscripts, Notes, Correspondence: Molecular Energetics Drafts ca. 1958

Series of untitled manuscripts for a proposed book.

 1.8 Manuscript: Lattices ca. 1950s 1.9 Manuscript: Scattering of X-rays by Matter ca. 1950s 1.10 Manuscript, Typescripts, Correspondence, Notes: The Nature of Orientational Defects in Ice November 1962 1.11 Typescript: Untitled discussion of the determination of molecular structure by X-ray diffraction methods ca. 1962 1.12 Typescripts, Correspondence, Referee's Report: Configuration, Conformation and Chirality 1965 1.13 Typescript, Notes, Correspondence: Silver Fluoride - Preparation from Silver Carbonate 1965-1967 1.14 Typescript: The Crystal Structure of Dibenzyl Phosphoric Acid, A Correction, by Jack Dunitz and J. S. Rollett 1968 1.15 Typescript, Notes, Correspondence, Visual Aids: Molecular Basis of Alkali Cation Transport by Macrocyclic Antibiotics of the Valinomycin Group, by Jack Dunitz and A. D. McLachlan April 1969 1.16 Manuscript, Correspondence: Pentagon (in Space) with All Angles and All Distances Equal Must Be Planar 1971 1.17 Typescript, Notes: Non-empirical SCF calculations on hydrogenlike molecules: the effect of nuclear charge on binding energy and bond length, by Jack Dunitz and T. K. Ha 1972 1.18 Typescript: The Early History of Silver Cyanate and Fulminate, by Doyle Britton and Jack Dunitz ca. 1970s 1.19 Typescript, Correspondence, Referees' Reports, Background Materials: Electron Density Distribution in the Organic Superconductor (TMTSF)2AsF6: Fact and Fancy December 1983 1.20 Typescript, Notes: Measurement of the State of Ionicity of the Atoms in Lithium Fluoroberyllate, a Conventionally Ionic Crystal ca. 1985 1.21 Typescript: Science Students, letter to the editor of The Economist by Jack Dunitz September 15, 1987 1.22 Typescripts: Edward Wesley Hughes (1904-1987) ca. 1988 1.23 Typescript: Personal Reminiscences, [re: the life and work of Alexander Isaakovich Kitaigorodsky] ca. 1989

Written as a preface for a special issue of Acta Chimica Hungarica, "Models in Chemistry - A. I. Kitaigorodskii Memorial Issue."

 1.24 Typescript: Conformational Polymorphism of Ferrocene, by Carolyn Brock, Daniel Selski, Emily Maverick and Jack Dunitz ca. 1989 1.25 Typescript: Distance Geometry and Molecular Conformation, by G. M. Crippen and T. F. Havel. John Wiley and Sons 1989 1.26 Manuscript, Typescript: Structural Variability of Aliphatic Nitro Groups, Yasushi Kai and Jack Dunitz ca. 1980s 1.27 Typescript: John Monteath Robertson (1900-1989) ca. 1990 1.28 Typescript: The Cambridge Structural Database as a New Scientific Tool February 7, 1991 1.29 Typescript: Linus Pauling - Born 1901, Still Going Strong May 1991 1.30 Typescript, Notes, Correspondence: Racemates and Conglomerates: Wallach's Rule, by Carolyn P. Brock, W. Bernd Schweizer and Jack D. Dunitz ca. 1991 4.002 Manuscripts of Articles by Jack Dunitz 1994-2006 undated 29 folders 2.1 Typescript, Correspondence: Linus Pauling (1901-1994); Some Personal Recollections September 1994 2.2 Typescript, Correspondence: A New Look at Proton Transfer Dynamics Along the Hydrogen Bonds in Amides and Peptides December 1994 2.3 Typescript, Correspondence: Linus Pauling, 1901-1994 ca. 1994 2.4 Typescript: LINUS CARL PAULING, 29 [sic] February 1901 - 19 August 1994, Elected For. Mem. R. S. 1948 ca. 1994 2.5 Typescript: LINUS CARL PAULING, 28 February 1901 - 19 August 1994 ca. 1994 2.6 Typescript, Correspondence, Background Materials: A New Look at Proton Transfer Dynamics Along the Hydrogen Bonds in Amides and Peptides 1994-1995 2.7 Typescript, Correspondence, Background Materials: Right and Left in Chiral Crystals February 1995 2.8 Correspondence, Background Materials: Disappearing Polymorphs ca. 1995 2.9 Typescript, Correspondence, Background Materials: Letter to the Editor of Chemical and Engineering News. [re: changes in the publication policy enforced by the Journal of the American Chemical Society] June 13, 1996

Published in the International Union of Crystallography Newsletter, 4, 3 (1996): 4.

 2.10 Typescript, Correspondence: Potassium Channels: the Dubious Role of K+..pi Interactions, by Robin Taylor and Jack Dunitz March 1996 2.11 Typescript: Force of Nature: the Life of Linus Pauling, by Thomas Hager. 1995. New York: Simon & Schuster. 721 pp. 1996 2.12 Typescript, Notes, Correspondence, Figures: Chemical Reaction Paths. IX. Visualization of Four-Dimensional Stereoisomerization Paths for Ph4X Molecules ca. 1997 2.13 Typescript: Verner Schomaker (1914-1997) ca. 1997 2.14 Typescript: Dorothy Crowfoot Hodgkin: an Introduction to her Work and Personality ca. 1997 2.15 Typescript: Recollections of Pre-Prebiotic Leslie Orgel ca. 1997 2.16 Typescript: Kenneth N. Trueblood (1920-1998) ca. 1998 2.17 Typescript: Encounters with Bragg ca. 1990s 2.18 Typescript: Right and Left at the Bürgenstock Conference 1973 ca. 1990s 2.19 Typescript: Ewald - Sommerfeld - von Laue anecdote ca. 1990s 2.20 Assorted untitled Dunitz typescripts and research materials re: the life and work of Linus Pauling ca. 1990s 2.21 Typescripts, Correspondence: Vladimir Prelog, 23 July 1906 - 7 January 1998, by Duilio Arigoni, Jack Dunitz and Albert Eschenmoser 2000 2.22 Typescripts, Galley Proofs, Correspondence, Background Materials: Pauling's left-handed alpha-helix June 2001 2.23 Typescript: Sir John Meurig Thomas at 70 2002 2.24 Typescript: Light is a Messenger: The life and science of William Lawrence Bragg, by Dr. Graeme K Hunter. Oxford University Press 2004 2.25 Typescript, Correspondence, Referee's Report: Exercises in Prognostication: Crystal Structures and Protein Folding 2004 2.26 Typescript, Correspondence: Are Crystal Structure [sic] Predictable? ca. 2004 2.27 Typescript: 1905 Anno Mirabilis: Albert Einstein's Influence on Modern Chemistry 2005 2.28 Typescript: The Pauling Catalogue, Oregon State University Libraries, Corvallis, OR, 2007, 6 vol., $125 2006 2.29 Typescripts: "Stories" undated

Series of short fiction stories written by Dunitz. Titles include Orpheus und Eurydice, Julia's Japanese Story, Captain Marinet - The Story of a Sailor, Bruno Leaves Home, Idomeno, Re di Creta, Astrochem and A Mysterious Visitor.

 4.003 Lectures by Jack Dunitz 1953-1976 14 folders 3.1 Manuscript: Untitled discussion of the application of quantum mechanics to chemistry, with special focus on the Molecular Orbital method ca. 1953 3.2 Manuscript: Cyclopentadienyl Talk ca. 1956 3.3 Typescript: Distortions from Cubic Symmetry 1957 3.4 Typescript, Background Materials: Untitled discussion of cyclobutadiene 1959 3.5 Typescripts: Untitled lecture on contemporary developments in crystallography, Inaugural Lecture, Swiss Federal Institute of Technology, Zurich, Switzerland ca. 1959

English and German-language typescripts.

 3.6 Manuscripts: X-ray analysis lectures ca. 1950s

Extensive series of lecture manuscripts discussing the specifics of x-ray analysis.

 3.7 Manuscript: Structural Investigations of Some Antibiotic Substances ca. 1960s 3.8 Notebook: X-Ray Diffraction Lectures - Disorder ca. 1960s 3.9 Typescript: Role of Diffraction Methods in Conformational Analysis, J. M. Robertson Symposium, Glasgow, Scotland September 1970 3.10 Typescript, Notes, Background Materials: A Simple Selection Rule for Electrocyclic Reactions ca. 1970 3.11 Typescript, Notes: The Future of Crystallography as an Academic Discipline, lecture delivered in London, England November 24, 1972 3.12 Manuscript, Notes: Untitled lecture on complexes of alkali and alkaline earth complexes with organic ligands ca. 1972 3.13 Typescript: Organische Chemie, Eschenmoser lecture, Basel, Switzerland March 26, 1976 3.14 Manuscript, Correspondence, Program, Background Materials: Chemical Research, International Agrarisch Centrum, Wageningen, The Netherlands May 26, 1976 4.004 Lectures by Jack Dunitz 1977-2006 undated 31 folders 4.1 Typescript, Notes: Von Kristallstrukturen zu chemischen Reacktionswegen. Keynote Speech, Annual General Meeting of the German Chemical Society, Munich, Germany September 14, 1977 4.2 Manuscript: Untitled lecture on non-bonded interactions ca. 1970s 4.3 Typescript, Background Materials: The Cyclohexane Ring ca. 1970s 4.4 Manuscript: Untitled lecture on the need to reconsider the initial classification of primary processes related to 3-coordinated and 5-coordinated species. Presented at the "Idea Centenary" ca. 1970s 4.5 Manuscript Notes re: untitled lecture on irregular coordination ca. 1970s 4.6 Manuscript: Physical Methods in Structure Analysis: Structure Analysis by X-ray Diffraction - Scope and Limitation ca. 1970s 4.7 Typescript, Notes: Crystal Structure and Chemical Reactivity ca. 1970s 4.8 Typescript: Untitled lecture on the physical and chemical properties of medium-sized alicyclic rings ca. 1970s 4.9 Typescript: Unverrichtete Dinge, ["Empty handed"] talk delivered at a celebration held at ETH Zürich July 7, 1989 4.10 Typescript, Correspondence, Background Materials: After-dinner Talk at the Symposium in Memory of David Ginsburg, Haifa September 19, 1989 4.11 Typescript: untitled German-language remarks delivered at a meeting of the Swiss Technion Society December 5, 1990 4.12 Lecture Notes, Photograph, Program: Eighteenth Course on Static, Kinematic and Dynamic Aspects of Crystal and Molecular Structure, International School of Crystallography. Erice, Italy. Hans-Beat Buergi and Jack D. Dunitz, directors May 30 - June 9, 1991

Includes a group photo of all who attended the conference in Erice. Dunitz is seated in the front row, sixth from left.

 4.13 Typescript, Program, Visual Aids: Phase Transitions in Molecular Crystals: A Chemical Viewpoint, Forty Years of Ferrocene and From Crystal Data Towards Chemical Reaction Paths, Robert Burns Woodward Lectureship, Harvard University April 14 - May 11, 1992 4.14 Typescript: Scientists and their Social Responsibility, manuscript prepared for a meeting of Fundacion BBV, Bilbao, Spain ca. September 1992 4.15 Typescript: untitled lecture on Dorothy Hodgkin and Linus Pauling. Published in Dorothy Hodgkin and Linus Pauling: A Tribute, talks presented at the Montreal meeting of the American Crystallographic Association July 25, 1995 4.16 Typescript: untitled reminiscence of Alexander Rich on the occasion of his receipt of an unknown award. Eugene, Oregon October 28, 1995 4.17 Typescript: Symmetry Considerations in Chemistry. Symposium on "Symmetry throughout the Sciences," Washington, D. C. November 25-27, 1997

Annotated "contains 'Dunitz's Conjecture'."

 4.18 Typescript: Thoughts on European Culture and Unity, meeting of Fundacion BBV, Bilbao, Spain October 4-5, 1998 4.19 Typescripts: Scientific Research - Panacea or Pandora's Box [alternatively titled by Dunitz as "Spain Talk."] ca. 1990s

Folder also contains a thematically related partial typescript titled "BBV Lecture."

 4.20 Manuscript: Untitled discussion of mathematical puzzles and Linus Pauling ca. 1990s 4.21 Typescript: Max Perutz, 1914-2002 ca. 2002 4.22 Typescript: untitled remarks delivered at a symposium held in celebration of Dunitz's eightieth birthday 2003 4.23 Abstract, Program: Are Crystal Structures Predictable? Conference on Non-Covalent Interactions in Chemistry and Biology, University of Cambridge September 16, 2004 4.24 Typescript: CCDC Dinner. Remarks made at the fortieth anniversary celebration of the Cambridge Crystallographic Data Centre September 23, 2005 4.25 Typescript, Background Materials: Edgar Heilbronner, 1921-2006 2006 4.26 Typescript: Sydney Brenner ca. 2000s 4.27 Typescript: The Golden Age at Caltech ca. 2000s 4.28 Manuscript: Notes on Hydrogen Bonding undated 4.29 Manuscript: Untitled introduction to x-ray crystallographic analysis undated 4.30 Manuscript: Untitled discussion of the relationship between crystal chemistry and the electronic structure of ions undated 4.31 Assorted non-Dunitz quotations for use in presentations and articles undated 4.005 Lecture Transparencies ca. 2000 5 folders 5.1 Lecture Transparencies re: crystal structure ca. 2000 5.2 Lecture Transparencies re: general and organic chemistry ca. 2000

Text primarily in German.

 5.3 Lecture Transparencies re: history of crystallography ca. 2000 5.4 Lecture Transparencies re: phase transitions and polymorphism ca. 2000 5.5 Lecture Transparencies re: symmetry ca. 2000 4.006 Assorted Transparencies, Figures and Visual Aids undated 1 folder 6.1 Assorted Transparencies, Figures and Visual Aids undated 4.007 Drawings for Slides undated 1 folder 7.1 Drawings for Slides undated

Drawings created for eventual conversion into lecture transparencies.

 5 Research Notes and Notebooks 1941-1989 5 boxes

Series 5 consists of research notes, arranged alphabetically by subject, and research notebooks, arranged chronologically. The diversity of topics represented in this series are indicative of the many scientific interests maintained by Dunitz over the course of his career.

 5.001 Research Notes 1946-1950 1953-1954 1966 1970 9 folders 1.1 Notes, Background Materials re: "Couper's Compound" 1966 1970

Includes x-ray crystallographic photographs labeled "Cooper's Compound."

 1.2 Notes re: crystal structure determinations ca. 1950s

Includes examinations of adamantane, cyclohexane, cyclohexene and cyclooctadiene among others.

 1.3 Notes re: electromagnetism ca. 1950s 1.4 Notes re: hemoglobin 1953-1954 1.5 Notes: "Method of Finding Maximum of Fourier Peak by Least Squares (Shoemaker)" ca. 1950s

Notes on a technique devised by David Shoemaker.

 1.6 Notes: "Molecular Statics" 1949-1950 1.7 Notes re: nitrogen ca. 1950s 1.8 Notes re: research reports 1946-1949 1.9 Notes re: ribonucleic acid 1953 1.10 Notes re: statistical thermodynamics 1946

Notes primarily from a lecture delivered by W. C. Orr.

 1.11 Notes re: sulphur ca. 1950s 1.12 Notes: "Waves" ca. 1950s 5.002 Research Notebooks 1941-1946 6 folders 2.1 Research Notebook: "Mathematics: Calculus, Infinite Series" 1941-1942 2.2 Research Notebook: "Mathematics: 3 Dimensional Coordinate Geometry, Partial Differentiation" 1944 2.3 Research Notebook: "Mathematics: Integral Calculus (Adv.), Differential Equations" 1944-1945 2.4 Research Notebook: "Acetylene Dicarboxylic Acid Dihydrate, Diacetylene Dicarboxylic Acid Dihydrate, Research Book I" 1944-1946 2.5 Research Notebook: "Physics; Triple Bond Calculations" 1944-1946 2.6 Research Notebook: "Acetylene Dicarboxylic Acid Dihydrate, Diacetylene Dicarboxylic Acid Dihydrate, Research Book II" 1945 5.003 Research Notebooks 1948-1951 6 folders 3.1 Research Notebook: "Electron Diffraction of Gas Molecules" 1948-1949 3.2 Research Notebook: "Calciferol Iodo-Nitro Benzoate" 1948-1949 3.3 Untitled Research Notebook 1949-1950

Notebook is primarily devoted to a detailed exploration of the structures of chloromycetin, bromamphenicol and aureomycin. Also includes notes on terramycin hydrochloride and isoplasmicide.

 3.4 Research Notebook: "Stercobilin Hydrochloride" 1949-1951

Also contains notes titled "Dimerisation Product of Acenaphthylene."

 3.5 Untitled Research Notebook 1950

Contains notes on quantum mechanics, the movement of electrons and the structure of the hydrogen molecule. Also contains notes on bond orbital hybridization, optics and the "4 electron problem."

 3.6 Untitled Research Notebook ca. 1951

Contains notes on Pauling's "Nature of the Chemical Bond" as well as a comparison of the valence bond and molecular orbital theories of chemical structure as utilized in colleague's publications.

 5.004 Research Notebooks 1952-1955 6 folders 4.1 Untitled Research Notebook 1952

First interior page is titled "Elementary Thermodynamics Notes."

 4.2 Untitled Research Notebook 1952-1953

Contains analyses of various crystal structures and notes on colleagues' structural chemistry publications.

 4.3 Untitled Research Notebook 1953-1954

Contains notes on nucleic acids and proteins, as well as colleagues' structural chemistry research.

 4.4 Research Notebook: "Misc Notes" 1954-1955

Contains notes on nucleic acids, hemoglobin, proteins and model building. Also contains notes on angular momentum and the movement of electrons.

 4.5 Research Notebook: "NIH Exp 54-55" 1954-1955

First interior page is titled "Experiments in Molecular Complex Formation Among Purines, Pyrimidines, etc." Also includes notes on nucleic acids and experiments on Na2S2O4.

 4.6 Research Notebook: "Misc 55" 1955

Contains notes on light scattering, molecular orbitals and assorted crystal structure determinations. Also contains work on ferrocene, sodium hydrosulfite and chromium dibenzene.

 5.005 Research Notebooks 1956 1967-1968 1970-1989 7 folders 5.1 Untitled Research Notebook 1956

Contains Dunitz's daily log of work that he has conducted as well as notes on colleagues' publications on a variety of topics.

 5.2 Research Notebook: "Diffractometer" 1967-1968 5.3 Untitled Research Notebook 1970-1974 1982 1985

Contains notes and calculations on a number of topics related to crystal structure.

 5.4 Research Notebook: "Mo Theorie" 1971-1972 5.5 Research Notebook: "Pentagons" June 1972 5.6 Research Notebook: "Literature" 1973-1978 5.7 Research Notebook: "Mathematics" 1973-1989 6 Subject Files 1927-2008 19 boxes

The subject files held in series 6 consist of notes and subject-specific publications collected and organized by Dunitz over time.

 6.001 Subject Files: A 1927-2002 4 folders 1.1 Notes, Publications re: alkali cation complexes 1969-2002 1.2 Notes, Publications re: amino acids 1969-2002 1.3 Notes, Publications re: aromatic compounds 1956-1987 1.4 Notes, Publications re: atomic motion in solids 1927-2000 6.002 Subject Files: B 1948-2004 5 folders 2.1 Publications re: bicyclobutanes 1977-1982 2.2 Notes, Publications re: biochemistry 1948-2004 2.3 Publications re: biographical sketches 1948-2004

Collected biographical materials related to various scientists.

 2.4 Publications re: Bond Energy Bond Order (BEBO) method 1960-1968 2.5 Notes, Publications re: bonds, orbitals and lone pairs 1951-1999 6.003 Chirality [1 of 2] 1964-2004 1 folder 3.1 Notes, Publications re: chirality [1 of 2] 1964-2004 6.004 Chirality [2 of 2] 1975-2001 1 folder 4.1 Notes, Publications re: Chirality [2 of 2] 1975-2001 6.005 Subject Files: Co - Cr 1940-2000 2 folders 5.1 Notes, Publications re: conformational analysis 1940-1986 5.2 Notes, Publications re: crystal structure determination 1953-2000 6.006 Subject Files: E 1969-2003 3 folders 6.1 Publications: "Eccentric Articles" 1981-2003

Articles relating to chemistry which Dunitz found to be outlandish. Dunitz has annotated one article as "Rubbish!"

 6.2 Notes, Publications re: electron density 1969-1990 6.3 Publications re: electron diffraction 1970-1990 6.007 Ferrocene [1 of 2] 1952-2005 2 folders 7.1 Notes, Publications re: ferrocene and other metallocenes 1953-2005 7.2 Notes, Publications re: ferrocene and other metallocenes 1952-2001 6.008 Ferrocene [2 of 2] 1953-1991 1 folder 8.1 Publications re: ferrocene and other metallocenes 1953-1991 6.009 Subject Files: Fo - G 1949-1983 2 folders 9.1 Notes, Publications re: force constants and reaction paths 1960-1983 9.2 Notes, Publications re: group theory 1949-1976 6.010 History of Chemistry 1938-1967 2003 2 folders 10.1 Publications re: history of chemistry 1938-1967

Files includes photocopy of A. L. Patterson's lengthy handwritten account of his 1926 visit to England.

 10.2 Publications re: history of DNA 2003 6.011 Subject Files: Hy 1953-2008 3 folders 11.1 Notes, Publications re: hydrogen bonding 1964-2008 11.2 Notes, Publications re: hydrogen gas 1953-1972 11.3 Notes, Publications re: hydrolysis 1972-1980 6.012 Subject Files: I - Mi 1950-1991 4 folders 12.1 Notes, Publications re: ice 1958-1965 12.2 Publications re: lithium compounds 1950-1991 12.3 Publications re: methadone 1973-1974 12.4 Notes, Publications re: middle rings 1956-1969 6.013 Molecular Geometry 1944-1983 1 folder 13.1 Notes, Publications, Visual Aids re: molecular geometry 1944-1983 6.014 Subject Files: N - Pa 1956-2005 4 folders 14.1 Publications re: neutron diffraction 1972 14.2 Notes, Publications re: nitroso compounds 1956-1982 14.3 Notes, Publications re: organic conductors 1978-1991 14.4 Publications re: packing in chemical structures 1962-2005 6.015 Phase Transitions 1957-2001 1 folder 15.1 Notes, Publications re: phase transitions 1957-2001 6.016 Subject Files: Pol - R 1940-2007 3 folders 16.1 Notes, Publications re: polymorphism 1940-2007 16.2 Notes, Publications re: potassium ion channels 1981-2001 16.3 Publications re: reactivity of organic solids 1990 6.017 Subject Files: Sp - St 1942-1998 2 folders 17.1 Notes, Publications re: space groups 1942-1998 17.2 Notes, Publications re: structure correlation 1965-1998 6.018 Subject Files: St - Sy 1935-2006 2 folders 18.1 Notes, Publications re: structure - miscellaneous 1935-2006 18.2 Notes, Publications re: symmetry 1962-1981 6.019 Subject Files: T - X 1937-2002 7 folders 19.1 Notes, Publications re: tetrahedra 1956-1976 19.2 Notes, Publications re: tobacco mosaic virus 1952-1955 19.3 Publications re: travel 1943-1948 19.4 Notes, Publications re: vitamin B12 1959-1982 19.5 Publications re: vitamin C 1953-1977 19.6 Publications re: Woodward-Hoffman rules 1937-1972 19.7 Notes, Publications re: x-ray analysis 1957-2002