Sample Originator: S. Beslia, A. Kilica and David B. Daviesb.
Data Collection: Simon J. Colesc
Structure Determination: Simon J. Colesc and Michael B. Hursthousec.
Gebze Institute of Technologya
Birkbeck College, University of Londonb
University of Southamptonc
C15H17Cl2N4OP3
InChI=1/C15H23Cl2N4OP3/c16-24(17)19-23(14-8-3-1-4-9-14,15-10-5-2-6-11-15)20-25(21-24)18-12-7-13-22-25/h1-6,8-11,18-21,23-25H,7,12-13H2
| Identification Number: | 10.5258/ecrystals/302 |
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| Controlled Keywords: | cyclophosphazene |
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| Date Created: | 28 March 2007 |
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| Deposited On: | 21 Jan 2008 15:30 |
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| Deposited By: | Dr Simon J Coles |
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Data collection parameters
| Chemical formula | C15 H17 Cl2 N4 O P3 |
| Crystal morphology | Prism |
| Crystal system | Tetragonal |
| Space group symbol | P4(1)2(1)2 |
| Cell length a | 9.41970(10) |
| Cell length b | 9.41970(10) |
| Cell length c | 42.3480(9) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 90.00 |
| Cell angle gamma | 90.00 |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0611 |
| R Factor (Obs) | 0.0563 |
| R Factor (All) | 0.0886 |
| Weighted R Factor (Obs) | 0.1448 |
| Weighted R Factor (All) | 0.1695 |
Citation: Besli, S. and Kilic, A. and Davies, David B. and Coles, Simon J. and Hursthouse, Michael B. (2007) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/302)
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