4-Amino-benzenesulfonamide 1-Morpholin-4-yl-ethanone solvate
Sample Originator: Simon J. Coles, Michael B. Hursthouse, Thomas A. Mayer and Terry L Threlfall. (C6H11NO2) . (C6H8N2O2S) InChI=1/C6H8N2O2S.C6H11NO2/c7-5-1-3-6(4-2-5)11(8,9)10;1-6(8)7-2-4-9-5-3-7/h1-4H,7H2,(H2,8,9,10);2-5H2,1H3
| Identification Number: | 10.5258/ecrystals/192 |
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| Controlled Keywords: | Strctural systematics, sulfonamides, sulfur drugs |
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| Date Created: | 11 November 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 | C12 H19 N3 O4 S | | Crystal morphology | | | Crystal system | monoclinic | | Space group symbol | P21/c | | Cell length a | 10.218(2) | | Cell length b | 8.8345(18) | | Cell length c | 16.655(3) | | Cell angle alpha | 90.00 | | Cell angle beta | 99.09(3) | | Cell angle gamma | 90.00 | | Data collection temperature | 293(2) |
Refinement results| Solution figure of merit | | | R Factor (Obs) | 0.0417 | | R Factor (All) | 0.0540 | | Weighted R Factor (Obs) | 0.1075 | | Weighted R Factor (All) | 0.1155 |
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/192)
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