International
Tables for
Crystallography
Volume C
Mathematical, physical and chemical tables
Edited by E. Prince

International Tables for Crystallography (2006). Vol. C, ch. 9.5, pp. 790-811
https://doi.org/10.1107/97809553602060000621

Chapter 9.5. Typical interatomic distances: organic compounds

F. H. Allen,a D. G. Watson,a L. Brammer,b A. G. Orpenc and R. Taylora

aCambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB2 1EZ, England,bDepartment of Chemistry, University of Missouri–St Louis, 8001 Natural Bridge Road, St Louis, MO 63121-4499, USA, and cSchool of Chemistry, University of Bristol, Bristol BS8 1TS, England

References

Allen, F. H., Bellard, S., Brice, M. D., Cartwright, B. A., Doubleday, A., Higgs, H., Hummelink, T., Hummelink-Peters, B. G., Kennard, O., Motherwell, W. D. S., Rodgers, J. R. & Watson, D. G. (1979). The Cambridge Crystallographic Data Centre: computer-based search, retrieval, analysis and display of information. Acta Cryst. B35, 2331–2339.
Bergerhoff, G., Hundt, R., Sievers, R. & Brown, I. D. (1983). The Inorganic Crystal Structure Database. J. Chem. Inf. Comput. Sci. 23, 66–70.
Cambridge Crystallographic Data Centre User Manual (1978). 2nd ed. Cambridge University, England.
Harmony, M. D., Laurie, R. W., Kuczkowski, R. L., Schwendemann, R. H., Ramsay, D. A., Lovas, F. J., Lafferty, W. J. & Maki, A. G. (1979). Molecular structures of gas-phase polyatomic molecules determined by spectroscopic methods. J. Phys. Chem. Ref. Data, 8, 619–721.
Kennard, O. (1962). Tables of bond lengths between carbon and other elements. International tables for X-ray crystallography, Vol. III, pp. 275–276. Birmingham: Kynoch Press.
Kennard, O., Watson, D. G., Allen, F. H., Isaacs, N. W., Motherwell, W. D. S., Pettersen, R. C. & Town, W. G. (1972). Molecular structures and dimensions, Vol. A1. Interatomic distances 1960–65. Utrecht: Oosthoek.
Sutton, L. E. (1958). Tables of interatomic distances and configuration in molecules and ions. Spec. Publ. No. 11. London: The Chemical Society.
Sutton, L. E. (1965). Tables of interatomic distances and configuration in molecules and ions. Spec. Publ. No. 18. London: The Chemical Society.
Taylor, R. & Kennard, O. (1983). The estimation of average molecular dimensions from crystallographic data. Acta Cryst. B39, 517–525.
Taylor, R. & Kennard, O. (1985). The estimation of average molecular dimensions. 2. Hypothesis testing with weighted and unweighted means. Acta Cryst. A41, 85–89.
Taylor, R. & Kennard, O. (1986). Cambridge Crystallographic Data Centre. 7. Estimating average molecular dimensions from the Cambridge Structural Database. J. Chem. Inf. Comput. Sci. 26, 28–32.