94SRC103 - C42H68B2N12Ni
Sample Originator: Jon A. McClevertya. Data Collection: Simon J. Colesb and Michael B. Hursthouseb Structure Determination: Simon J. Colesb. University of Bristola
University of Southamptonb
C42H68B2N12Ni InChI=1/C14H23BN4.C7H11N2.Ni/c1-7-13-9(3)16-18(11(13)5)15-19-12(6)14(8-2)10(4)17-19;1-4-7-5(2)8-9-6(7)3;/h15H,7-8H2,1-6H3;4H2,1-3H3;/q;-1;+1 | Identification Number: | 10.5258/ecrystals/1033 |
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| Controlled Keywords: | nickel compounds |
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| Date Created: | 06 June 1994 |
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| Deposited On: | 10 Jun 2013 17:27 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters| Chemical formula | C42 H68 B2 N12 Ni | | Crystal morphology | | | Crystal system | monoclinic | | Space group symbol | P2(1)/n | | Cell length a | 10.127(2) | | Cell length b | 12.575(2) | | Cell length c | 17.633(2) | | Cell angle alpha | 90.00 | | Cell angle beta | 90.223(7) | | Cell angle gamma | 90.00 | | Data collection temperature | 120(2) |
Refinement results| Solution figure of merit | | | R Factor (Obs) | 0.0435 | | R Factor (All) | 0.0769 | | Weighted R Factor (Obs) | 0.0846 | | Weighted R Factor (All) | 0.0897 |
Citation: McCleverty, Jon A. and Coles, Simon J. and Hursthouse, Michael B. (1994) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/1033)
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