Using small molecule crystal structure data to obtain information about sulfonamide conformation

Acta Crystallographica Section B: Structural Science

Volumn 64, Issue 1, 2008, Pages 66-71

  Parkin, Andrew ^a   Collins, Anna ^a,b   Gilmore, Christopher J ^a   Wilson, Chick C ^a  

^a UNIVERSITY OF GLASGOW   (United Kingdom)

^b UNIVERSITY OF EDINBURGH   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

CLUSTER ANALYSIS; CONFORMATIONS; MOLECULAR STRUCTURE; SOLID STATE REACTIONS; TORSIONAL STRESS;

CAMBRIDGE STRUCTURAL DATABASE (CSD); HIGH-LEVEL AB INITIO CALCULATIONS; SOLID-STATE STRUCTURE;

CRYSTAL STRUCTURE;

EID: 38749129703     PISSN: 01087681     EISSN: 01087681     Source Type: Journal    
DOI: 10.1107/S0108768107065895     Document Type: Article

References (14)

1. Allen, F. H. (2002). Acta Cryst B58, 380-388.
2. Barr, G., Dong, W., Gilmore, C. J., Parkin, A. & Wilson, C. C. (2005). J. Appl. Cryst. 38, 833-841.
3. Bindal, R. D., Golab, J. T. & Katzenellenbogen, J. A. (1990). J. Am. Chem. Soc. 112, 7861-7868.
4. Bock, H., Nagel, N. & Naether, C. (1998). Z. Naturforsch. B, 53, 1389-1400.
5. Bürgi, H.-B. & Dunitz, X D. (1994). Structure Correlation, Vola 1 and 2. New York: VCH Publishers, Inc.
6. Collins, A., Barr, G., Dong, W., Gilmore, C. J., Middlemiss, D. S., Parkin, A, & Wilson, C. C. (2007). Acta Cryst. B63, 469-476.
7. Collins, A., Parkin, A., Barr, G., Dong, W., Gilmore, C. J. & Wilson, C. C. (2007). CrystEngComm, 9, 245-253.
8. Heyd, J., Thiel, W. & Weber, W. (1997). J. Mol. Struct. Theochem. 391, 125-130.
9. Higgs, T. C., Parkin, A., Parsons, S. & Tasker, P. A. (2002). Acta Cryst E58, o523-o525.
10. Liang, G., Bays, J. P. & Bowen, J. P. (1997). J. Mol. Struct. Theochem. 401, 165-179.
11. Nicholas, J. B., Vance, R., Martin, E., Burke, B. J. & Hopfinger, A. J. (1991). J. Phys. Chem. 95, 9803-9811.
12. Parkin, A., Barr, G., Collins, A., Dong, W., Gilmore, C. J.,Tasker, P. A. & Wilson, C. C. (2007). Acta Cryst. B63, 612-620.
13. Parkin, A., Barr, G., Dong, W., Gilmore, C. J. & Wilson, C. C. (2006). CrystEngComm, 8, 257-264.
14. Senger, S., Chan, C., Convery, M. A., Hubbard, J. A., Shah, G. P., Watson, N. S. & Young, R. J. (2007). Bioorg. Med. Chem. Lett 17, 2931-2934.