Sample Originator: Robert S. Warda.
Data Collection: Simon J. Colesb and Michael B. Hursthouseb
Structure Determination: Simon J. Colesb.
University College of Swanseaa
University of Southamptonb
C26H30O9
InChI=1/C26H30O9/c1-14(27)34-25-18-11-23(32-6)22(31-5)10-17(18)24(16-7-8-20(29-3)21(9-16)30-4)19-12-33-13-26(19,25)35-15(2)28/h7-11,19,24-25H,12-13H2,1-6H3/t19-,24+,25+,26-/m1/s1
| Date Created: | 02 February 2000 |
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| Deposited On: | 23 Dec 2014 13:29 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C26 H30 O9 |
| Crystal morphology | |
| Crystal system | Orthorhombic |
| Space group symbol | P212121 |
| Cell length a | 8.3420(17) |
| Cell length b | 12.846(3) |
| Cell length c | 22.736(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) | 0.0427 |
| R Factor (All) | 0.0658 |
| Weighted R Factor (Obs) | 0.0957 |
| Weighted R Factor (All) | 0.1050 |
Citation: Ward, Robert S. and Coles, Simon J. and Hursthouse, Michael B. (2000) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/771/)
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