Sample Originator: Ian R. Butlera.
Data Collection: Simon J. Colesb, K.M. Abdul Malikc and Michael B. Hursthouseb
Structure Determination: Simon J. Colesb and K.M. Abdul Malikc.
University of Wales, Bangora
University of Southamptonb
University of Cardiffc
C20H22Cl2FePdS4
InChI=1/C10H13S2.C10H12S2.2ClH.Fe.Pd/c2*1-2-5-9(4-1)8-10-11-6-3-7-12-10;;;;/h1,4-5,8-9H,2-3,6-7H2;1-2,4-5,8-9H,3,6-7H2;2*1H;;/q;;;;;+2/p-2
| Identification Number: | 10.5258/ecrystals/1017 |
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| Controlled Keywords: | palladium compounds, iron |
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| Date Created: | 17 February 1994 |
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| Deposited On: | 10 Jun 2013 17:32 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C20 H22 Cl2 Fe Pd S4 |
| Crystal morphology | |
| Crystal system | monoclinic |
| Space group symbol | P2(1)/c |
| Cell length a | 12.3174(18) |
| Cell length b | 12.9617(9) |
| Cell length c | 14.791(3) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 107.619(15) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | |
| R Factor (Obs) | 0.0330 |
| R Factor (All) | 0.0379 |
| Weighted R Factor (Obs) | 0.0805 |
| Weighted R Factor (All) | 0.0814 |
Citation: Butler, Ian R. and Coles, Simon J. and Malik, K.M. Abdul and Hursthouse, Michael B. (1994) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/1017)
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