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04SRC560 - C40H54B2Sn

Sample Originator: Andy Peltera.

Data Collection: Simon J. Colesb and Michael B. Hursthouseb

Structure Determination: Simon J. Colesb.

University College of Swanseaa
University of Southamptonb

C40H54B2Sn

InChI=1/2C19H24B.2CH3.Sn/c2*1-12-8-14(3)18(15(4)9-12)20(7)19-16(5)10-13(2)11-17(19)6;;;/h2*8-11H,7H2,1-6H3;2*1H3;

Controlled Keywords:metallacarboranes, tin complexes
Date Created:11 August 2004
Deposited On:23 Dec 2014 09:49
Deposited By:Mr Steve Lamond

Data collection parameters

Chemical formulaC40 H54 B2 Sn
Crystal morphologySlab
Crystal systemTriclinic
Space group symbolP-1
Cell length a8.5152(9)
Cell length b9.6458(3)
Cell length c21.897(5)
Cell angle alpha86.955(6)
Cell angle beta85.97(2)
Cell angle gamma84.691(6)
Data collection temperature120(2)

Refinement results

Solution figure of merit
R Factor (Obs)0.1280
R Factor (All)0.1354
Weighted R Factor (Obs)0.3258
Weighted R Factor (All)0.3308

Citation: Pelter, Andy and Coles, Simon J. and Hursthouse, Michael B. (2004) University of Southampton, Crystal Structure Report Archive. (http://ecrystals.chem.soton.ac.uk/893/)
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