Sample Originator: Peter J. Skabaraa.
Data Collection: Peter N. Hortonb and Michael B. Hursthouseb
Structure Determination: Peter N. Hortonb.
University of Strathclydea
University of Southamptonb
C23H24O4S3
InChI=1/C23H24O4S3/c1-24-14-6-8-16(18(12-14)26-3)20-22-23(29-11-5-10-28-22)21(30-20)17-9-7-15(25-2)13-19(17)27-4/h6-9,12-13H,5,10-11H2,1-4H3
| Controlled Keywords: | organic compounds |
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| Date Created: | 07 February 2003 |
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| Deposited On: | 16 Feb 2010 14:48 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C23 H24 O4 S3 |
| Crystal morphology | |
| Crystal system | Monoclinic |
| Space group symbol | P2(1)/c |
| Cell length a | 8.4623(3) |
| Cell length b | 32.2548(12) |
| Cell length c | 8.4765(2) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 113.146(2) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0672 |
| R Factor (Obs) | 0.0455 |
| R Factor (All) | 0.0930 |
| Weighted R Factor (Obs) | 0.0859 |
| Weighted R Factor (All) | 0.0988 |
Citation: Skabara, Peter J. and Horton, Peter N. and Hursthouse, Michael B. (2003) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/1159/)
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