Sample Originator: Simon J. Coles, Michael B. Hursthouse, Thomas A. Mayer and Terry L Threlfall.



Identification Number:10.5258/ecrystals/178
Controlled Keywords:Structural systematics, sulfonamides, sulfur drugs
Date Created:30 February 2000
Deposited On:21 Jan 2008 15:28
Deposited By:A.N. Admin

Data collection parameters

Chemical formulaC12 H13 N3 O2 S
Crystal morphology
Crystal systemmonoclinic
Space group symbolC2/c
Cell length a18.175(4)
Cell length b8.1029(16)
Cell length c16.535(3)
Cell angle alpha90.00
Cell angle beta91.08(3)
Cell angle gamma90.00
Data collection temperature150(2)

Refinement results

Solution figure of merit
R Factor (Obs)0.0374
R Factor (All)0.0471
Weighted R Factor (Obs)0.0979
Weighted R Factor (All)0.1041

Citation: Coles, Simon J. and Hursthouse, Michael B. and Mayer, Thomas A. and Threlfall, Terry L (2000) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/178)
Export as: oreChem EndNote BibTeX ASCII Citation

Repository Staff Only: item control page