Sample Originator: Ian R. Butlera.
Data Collection: Peter N. Hortonb and Michael B. Hursthouseb
Structure Determination: Peter N. Hortonb.
University of Wales, Bangora
University of Southamptonb
C20H20BrNO2Si
InChI=1/C20H20BrNO2Si/c1-12-11-15(21)17-16(18(12)22)19(23)13-7-5-6-8-14(13)20(17,24)9-10-25(2,3)4/h5-8,11,24H,22H2,1-4H3/t20-/m0/s1
| Identification Number: | 10.5258/ecrystals/923 |
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| Controlled Keywords: | catalysis |
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| Date Created: | 06 October 2004 |
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| Deposited On: | 23 Dec 2014 09:37 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C20 H20 Br N O2 Si |
| Crystal morphology | Needle |
| Crystal system | triclinic |
| Space group symbol | P-1 |
| Cell length a | 6.7406(14) |
| Cell length b | 11.7940(19) |
| Cell length c | 11.945(3) |
| Cell angle alpha | 87.687(17) |
| Cell angle beta | 86.67(2) |
| Cell angle gamma | 81.403(18) |
| Data collection temperature | 120(2) |
Refinement results
| Solution figure of merit | 0.0524 |
| R Factor (Obs) | 0.0402 |
| R Factor (All) | 0.0584 |
| Weighted R Factor (Obs) | 0.0718 |
| Weighted R Factor (All) | 0.0774 |
Citation: Butler, Ian R. and Horton, Peter N. and Hursthouse, Michael B. (2004) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/923)
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