Sample Originator: S. J. Green.
Data Collection: Simon J. Colesa, K.M. Abdul Malikb and Michael B. Hursthousea
Structure Determination: Simon J. Colesa and K.M. Abdul Malikb.
University of Southamptona
University of Cardiffb
C46H49BF15Mo
InChI=1/C15H26.C15H25.C12HBF10.C6HF5.2Mo/c2*1-10(2)13-7-14(11(3)4)9-15(8-13)12(5)6;14-3-1(4(15)8(19)11(22)7(3)18)13-2-5(16)9(20)12(23)10(21)6(2)17;7-2-1-3(8)5(10)6(11)4(2)9;;/h7-14H,1-6H3;7-13H,1-6H3;13H;1H;;/t13-,14?;;;;;/m1...../s1
| Identification Number: | 10.5258/ecrystals/1037 |
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| Controlled Keywords: | molybdenum complexes |
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| Date Created: | 22 November 1995 |
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| Deposited On: | 14 Aug 2013 23:19 |
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| Deposited By: | Mr Steve Lamond |
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Data collection parameters
| Chemical formula | C48 H49 B F15 Mo |
| Crystal morphology | |
| Crystal system | Triclinic |
| Space group symbol | P-1 |
| Cell length a | 9.891(3) |
| Cell length b | 10.667(3) |
| Cell length c | 22.197(6) |
| Cell angle alpha | 101.544(13) |
| Cell angle beta | 91.41(2) |
| Cell angle gamma | 99.83(2) |
| Data collection temperature | 140(2) |
Refinement results
| Solution figure of merit | |
| R Factor (Obs) | 0.0535 |
| R Factor (All) | 0.0791 |
| Weighted R Factor (Obs) | 0.1381 |
| Weighted R Factor (All) | 0.1331 |
Citation: Green, S. J. and Coles, Simon J. and Malik, K.M. Abdul and Hursthouse, Michael B. (1995) University of Southampton, Crystal Structure Report Archive. (doi:10.5258/ecrystals/1037)
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