Sample Originator: Stan. M. Robertsa.
Data Collection: Dai. E. Hibbsb and Michael B. Hursthousec
Structure Determination: Dai. E. Hibbsb and Steven J. Lamondc.
University of Liverpoola
University of Sydneyb
University of Southamptonc
C14H9ClO7
InChI=1/C14H9ClO7/c1-5(16)21-10-4-9(19)11-12(14(10)22-6(2)17)8(18)3-7(15)13(11)20/h3-4,19H,1-2H3
| Date Created: | 24 December 1994 |
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| Deposited On: | 23 Dec 2014 13:32 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C14 H9 Cl O7 |
| Crystal morphology | |
| Crystal system | monoclinic |
| Space group symbol | C2/c |
| Cell length a | 16.0510(8) |
| Cell length b | 5.5590(8) |
| Cell length c | 30.980(9) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 96.99(2) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 140(2) |
Refinement results
| Solution figure of merit | |
| R Factor (Obs) | 0.0859 |
| R Factor (All) | 0.1208 |
| Weighted R Factor (Obs) | 0.2277 |
| Weighted R Factor (All) | 0.2499 |
Citation: Roberts, Stan. M. and Hibbs, Dai. E. and Hursthouse, Michael B. and Lamond, Steven J. (1994) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/821/)
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