98SRC145(1125) - C19H17Cl3
Sample Originator: Mark S. Bairda. Data Collection: Mark E. Lightb and Michael B. Hursthouseb Structure Determination: Mark E. Lightb. University of Wales, Bangora
University of Southamptonb
C19H17Cl3 InChI=1/C19H17Cl3/c1-13(12-20)18(21)19(22)16(14-8-4-2-5-9-14)17(19)15-10-6-3-7-11-15/h2-11,16-17H,12H2,1H3/b18-13+/t16-,17-/m0/s1 | Identification Number: | 10.5258/ecrystals/746 |
|---|
| Date Created: | 19 May 1998 |
|---|
| Deposited On: | 14 Aug 2013 23:46 |
|---|
| Deposited By: | Mr Steve Lamond |
|---|
Data collection parameters| Chemical formula | C19 H17 Cl3 | | Crystal morphology | | | Crystal system | monoclinic | | Space group symbol | P2(1)/c | | Cell length a | 12.242(2) | | Cell length b | 9.8900(10) | | Cell length c | 14.073(2) | | Cell angle alpha | 90.00 | | Cell angle beta | 97.89(2) | | Cell angle gamma | 90.00 | | Data collection temperature | 150(2) |
Refinement results| Solution figure of merit | | | R Factor (Obs) | 0.0425 | | R Factor (All) | 0.1011 | | Weighted R Factor (Obs) | 0.0947 | | Weighted R Factor (All) | 0.1046 |
Citation: Baird, Mark S. and Light, Mark E. and Hursthouse, Michael B. (1998) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/746)
Export as: oreChem EndNote BibTeX ASCII Citation Available FilesFinal ResultValidationRefinementProcessingOther Files   Repository Staff Only: item control page
|
