N-(4-Methyl-1H-pyridin-2-ylidene)-benzenesulfonamide
Sample Originator: Simon J. Coles, Michael B. Hursthouse, Thomas A. Mayer and Terry L Threlfall. C12H12N2O2S InChI=1/C12H12N2O2S/c1-10-7-8-13-12(9-10)14-17(15,16)11-5-3-2-4-6-11/h2-9H,1H3,(H,13,14)
| Identification Number: | 10.5258/ecrystals/177 |
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| Controlled Keywords: | Structural systematics, sulfonamides, sulfur drugs |
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| Date Created: | 25 October 2000 |
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| Deposited On: | 21 Jan 2008 15:28 |
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| Deposited By: | A.N. Admin |
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Data collection parameters| Chemical formula | C12 H12 N2 O2 S | | Crystal morphology | | | Crystal system | orthorhombic | | Space group symbol | Pbca | | Cell length a | 8.8098(18) | | Cell length b | 10.574(2) | | Cell length c | 24.736(5) | | Cell angle alpha | 90.00 | | Cell angle beta | 90.00 | | Cell angle gamma | 90.00 | | Data collection temperature | 150(2) |
Refinement results| Solution figure of merit | | | R Factor (Obs) | 0.0441 | | R Factor (All) | 0.0666 | | Weighted R Factor (Obs) | 0.1096 | | Weighted R Factor (All) | 0.1208 |
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/177)
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