Sample Originator: Robert S. Warda.
Data Collection: Mary Harmanb and Michael B. Hursthousec
Structure Determination: Mary Harmanb.
University College of Swanseaa
University of Wales, Cardiffb
University of Southamptonc
C20H20O5
InChI=1/C20H20O5/c1-23-17-8-12-7-13-11-25-19(22)15(13)10-20(5-3-14(21)4-6-20)16(12)9-18(17)24-2/h3-6,8-9,13,15H,7,10-11H2,1-2H3/t13-,15+/m1/s1
| Identification Number: | 10.5258/ecrystals/1021 |
|---|
| Controlled Keywords: | organic compounds |
|---|
| Date Created: | 11 March 1992 |
|---|
| Deposited On: | 14 Aug 2013 23:24 |
|---|
| Deposited By: | Mr Steve Lamond |
|---|
Data collection parameters
| Chemical formula | C80 H80 O20 |
| Crystal morphology | |
| Crystal system | monoclinic |
| Space group symbol | P2(1)/n |
| Cell length a | 9.700 |
| Cell length b | 10.470 |
| Cell length c | 16.580 |
| Cell angle alpha | 90.00 |
| Cell angle beta | 92.55 |
| Cell angle gamma | 90.00 |
| Data collection temperature | 293(2) |
Refinement results
| Solution figure of merit | |
| R Factor (Obs) | 0.0434 |
| R Factor (All) | 0.0589 |
| Weighted R Factor (Obs) | 0.0986 |
| Weighted R Factor (All) | 0.1158 |
Citation: Ward, Robert S. and Harman, Mary and Hursthouse, Michael B. (1992) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/1021)
Export as: oreChem EndNote BibTeX ASCII Citation
