01SRC002 - C16H16ClN2PPdS
Sample Originator: Martin B. Smitha. Data Collection: Simon J. Colesb and Michael B. Hursthouseb Structure Determination: Simon J. Colesb. Loughborough Universitya
University of Southamptonb
C16H16ClN2PPdS InChI=1/2C15H13N2PS.2CH3.2ClH.2Pd/c2*1-3-7-13(8-4-1)18(14-9-5-2-6-10-14)17-15-16-11-12-19-15;;;;;;/h2*1-12H,(H,16,17);2*1H3;2*1H;; | Identification Number: | 10.5258/ecrystals/1024 |
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| Controlled Keywords: | palladium compounds |
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| Date Created: | 13 January 2001 |
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| Deposited On: | 14 Aug 2013 23:29 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters| Chemical formula | C16 H16 Cl N2 P Pd S | | Crystal morphology | | | Crystal system | Monoclinic | | Space group symbol | P2(1)/c | | Cell length a | 11.628(2) | | Cell length b | 16.911(3) | | Cell length c | 17.514(4) | | Cell angle alpha | 90.00 | | Cell angle beta | 94.92(3) | | Cell angle gamma | 90.00 | | Data collection temperature | 150(2) |
Refinement results| Solution figure of merit | | | R Factor (Obs) | 0.0326 | | R Factor (All) | 0.0456 | | Weighted R Factor (Obs) | 0.0739 | | Weighted R Factor (All) | 0.0792 |
Citation: Smith, Martin B. and Coles, Simon J. and Hursthouse, Michael B. (2001) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/1024)
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