Sample Originator: David B. Daviesb, A. Kilicc and A. Usluc.
Data Collection: Simon J. Colesa
Structure Determination: Simon J. Colesa and Michael B. Hursthousea.
University of Southamptona
Birkbeck College, University of Londonb
Gebze Institute of Technologyc
C4H8Cl4N3O2P3
InChI=1/C4H14Cl4N3O2P3/c1-4-2-12-16(13-3-4)10-14(5,6)9-15(7,8)11-16/h4,9-11,14-16H,2-3H2,1H3
| Identification Number: | 10.5258/ecrystals/484 |
|---|
| Date Created: | 05 July 2008 |
|---|
| Deposited On: | 05 Jul 2008 21:10 |
|---|
| Deposited By: | Dr Simon J Coles |
|---|
Data collection parameters
| Chemical formula | C4 H8 Cl4 N3 O2 P3 |
| Crystal morphology | Block |
| Crystal system | Monoclinic |
| Space group symbol | Cc |
| Cell length a | 14.8296(9) |
| Cell length b | 6.0926(3) |
| Cell length c | 15.4113(12) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 109.500(3) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0324 |
| R Factor (Obs) | 0.0658 |
| R Factor (All) | 0.0961 |
| Weighted R Factor (Obs) | 0.1561 |
| Weighted R Factor (All) | 0.1817 |
Citation: Coles, Simon J. and Hursthouse, Michael B. and Davies, David B. and Kilic, A. and Uslu, A. (2008) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/484)
Export as: oreChem EndNote BibTeX ASCII Citation
