Sample Originator: Robert A. Shawa and David B. Daviesa.
Data Collection: Simon J. Colesb and Michael B. Hursthouseb
Structure Determination: Simon J. Colesb.
Birkbeck College, University of Londona
University of Southamptonb
C24H61ClN9OP3
InChI=1/C24H66N9P3.Cl2.ClH.H2O/c1-19(2,3)25-34(26-20(4,5)6)31-35(27-21(7,8)9,28-22(10,11)12)33-36(32-34,29-23(13,14)15)30-24(16,17)18;1-2;;/h25-36H,1-18H3;;1H;1H2
| Controlled Keywords: | phosphazenes |
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| Date Created: | 26 March 2001 |
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| Deposited On: | 16 Feb 2010 12:42 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C24 H61 Cl N9 O P3 |
| Crystal morphology | |
| Crystal system | Monoclinic |
| Space group symbol | C2/c |
| Cell length a | 33.651(7) |
| Cell length b | 11.506(2) |
| Cell length c | 19.895(4) |
| Cell angle alpha | 90.00 |
| Cell angle beta | 107.44(3) |
| Cell angle gamma | 90.00 |
| Data collection temperature | 150(2) |
Refinement results
| Solution figure of merit | |
| R Factor (Obs) | 0.0654 |
| R Factor (All) | 0.1091 |
| Weighted R Factor (Obs) | 0.1799 |
| Weighted R Factor (All) | 0.2083 |
Citation: Shaw, Robert A. and Davies, David B. and Coles, Simon J. and Hursthouse, Michael B. (2001) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/782/)
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