2-Benzenesulfonylamino-3H-thiazol-1-ylium
Sample Originator: Simon J. Coles, Michael B. Hursthouse, Thomas A. Mayer and Terry L Threlfall. C9H8N2O2S2 InChI=1/C9H8N2O2S2/c12-15(13,8-4-2-1-3-5-8)11-9-10-6-7-14-9/h1-7,10H/q+1
| Identification Number: | 10.5258/ecrystals/191 |
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| Controlled Keywords: | Structural systematics, sulfonamides, sulfur drugs |
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| Date Created: | 18 September 2000 |
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| Deposited On: | 21 Jan 2008 15:29 |
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| Deposited By: | A.N. Admin |
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Data collection parameters| Chemical formula | C9 H8 N2 O2 S2 | | Crystal morphology | | | Crystal system | monoclinic | | Space group symbol | P21/n | | Cell length a | 5.5166(11) | | Cell length b | 8.7652(18) | | Cell length c | 20.695(4) | | Cell angle alpha | 90.00 | | Cell angle beta | 96.25(3) | | Cell angle gamma | 90.00 | | Data collection temperature | 293(2) |
Refinement results| Solution figure of merit | | | R Factor (Obs) | 0.0440 | | R Factor (All) | 0.0711 | | Weighted R Factor (Obs) | 0.0988 | | Weighted R Factor (All) | 0.1113 |
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/191)
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