N-(1,4-Dihydro-pyrimidin-2-yl)-benzenesulfonamide
Sample Originator: Simon J. Coles, Michael B. Hursthouse, Thomas A. Mayer and Terry L Threlfall. C10H9N3O2S InChI=1/C10H9N3O2S/c14-16(15,9-5-2-1-3-6-9)13-10-11-7-4-8-12-10/h1-8H,(H,11,13,14)
| Identification Number: | 10.5258/ecrystals/188 |
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| Controlled Keywords: | Structural systematics, sulfonamides, sulfur drugs |
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| Date Created: | 03 April 2000 |
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| Deposited On: | 21 Jan 2008 15:27 |
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| Deposited By: | A.N. Admin |
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Data collection parameters| Chemical formula | C10 H9 N3 O2 S | | Crystal morphology | | | Crystal system | monoclinic | | Space group symbol | P21/c | | Cell length a | 11.748(2) | | Cell length b | 5.9187(12) | | Cell length c | 14.655(3) | | Cell angle alpha | 90.00 | | Cell angle beta | 99.30(3) | | Cell angle gamma | 90.00 | | Data collection temperature | 150(2) |
Refinement results| Solution figure of merit | | | R Factor (Obs) | 0.0432 | | R Factor (All) | 0.0689 | | Weighted R Factor (Obs) | 0.1020 | | Weighted R Factor (All) | 0.1138 |
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/188)
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