Sample Originator: P. G. Taylora.
Data Collection: Samantha K. Callearb and Michael B. Hursthouseb
Structure Determination: Samantha K. Callearb.
Open Universitya
University of Southamptonb
C15H19ClN4O7Si
InChI=1/C15H19N4O6Si.ClH.H2O/c1-10-4-12(18(20)21)14-16(6-10)8-26(3,24-14)9-17-7-11(2)5-13(19(22)23)15(17)25-26;;/h4-7H,8-9H2,1-3H3,(H,20,21)(H,22,23);1H;1H2
| Identification Number: | 10.5258/ecrystals/711 |
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| Date Created: | 12 May 2009 |
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| Deposited On: | 15 Nov 2009 18:32 |
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| Deposited By: | Dr Samantha K Callear |
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Data collection parameters
| Chemical formula | C15 H19 Cl N4 O7 Si |
| Crystal morphology | Block |
| Crystal system | orthorhombic |
| Space group symbol | Pbca |
| Cell length a | 6.8700(3) |
| Cell length b | 23.3867(14) |
| Cell length c | 24.3510(15) |
| 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 | |
| R Factor (Obs) | 0.1744 |
| R Factor (All) | 0.1940 |
| Weighted R Factor (Obs) | 0.3437 |
| Weighted R Factor (All) | 0.3534 |
Citation: Taylor, P. G. and Callear, Samantha K. and Hursthouse, Michael B. (2009) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/711)
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