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



Identification Number:10.5258/ecrystals/180
Controlled Keywords:Structural systematics, sulfur drugs, sulfonamides
Date Created:28 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 a15.837(3)
Cell length b8.6247(17)
Cell length c18.643(4)
Cell angle alpha90.00
Cell angle beta94.14(3)
Cell angle gamma90.00
Data collection temperature293(2)

Refinement results

Solution figure of merit
R Factor (Obs)0.0490
R Factor (All)0.1040
Weighted R Factor (Obs)0.1077
Weighted R Factor (All)0.1276

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/180)
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