Sample Originator: Robin B. Bedforda.
Data Collection: Simon J. Colesb and Michael B. Hursthouseb
Structure Determination: Simon J. Colesb.
Bristol Universitya
University of Southamptonb
C12H11O2P
InChI=1/C12H11O2P/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H,(H,13,14)
| Controlled Keywords: | organic compounds, catalysis |
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| Date Created: | 19 November 2004 |
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| Deposited On: | 16 Feb 2010 16:08 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C12 H11 O2 P |
| Crystal morphology | Prism |
| Crystal system | Monoclinic |
| Space group symbol | P2(1)/c |
| Cell length a | 11.4202(15) |
| Cell length b | 5.9417(7) |
| Cell length c | 15.6075(14) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 100.132(8) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0556 |
| R Factor (Obs) | 0.0362 |
| R Factor (All) | 0.0386 |
| Weighted R Factor (Obs) | 0.0975 |
| Weighted R Factor (All) | 0.0993 |
Citation: Bedford, Robin B. and Coles, Simon J. and Hursthouse, Michael B. (2004) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1093/)
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