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04SRC845 - C20H20BrNO2Si

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
Controlled Keywords:catalysis
Date Created:06 October 2004
Deposited On:23 Dec 2014 09:37
Deposited By:Mr Steve Lamond

Data collection parameters

Chemical formulaC20 H20 Br N O2 Si
Crystal morphologyNeedle
Crystal systemtriclinic
Space group symbolP-1
Cell length a6.7406(14)
Cell length b11.7940(19)
Cell length c11.945(3)
Cell angle alpha87.687(17)
Cell angle beta86.67(2)
Cell angle gamma81.403(18)
Data collection temperature120(2)

Refinement results

Solution figure of merit0.0524
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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