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Information card for entry 2224773
Preview
Coordinates | 2224773.cif |
---|---|
Structure factors | 2224773.hkl |
Original IUCr paper | HTML |
Chemical name | 1κ^3^<i>C</i>,2κ^3^<i>C</i>,3κ^3^<i>C</i>-[tris(4-\ chlorophenyl)phosphine-3κ<i>P</i>]-<i>triangulo</i>-triruthenium(0)} chloroform monosolvate |
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Formula | C105 H69 As4 Cl9 O18 P2 Ru6 |
Calculated formula | C105 H69 As4 Cl9 O18 P2 Ru6 |
SMILES | [Ru]12([Ru]([Ru]1([P](c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1ccc(Cl)cc1)(C#[O])(C#[O])C#[O])([As](C[As]2(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O].ClC(Cl)Cl |
Title of publication | Bis{[μ-bis(diphenylarsino)methane-1:2κ^2^<i>As</i>:<i>As</i>']nonacarbonyl-1κ^3^<i>C</i>,2κ^3^<i>C</i>,3κ^3^<i>C</i>-[tris(4-chlorophenyl)phosphine-3κ<i>P</i>]-<i>triangulo</i>-triruthenium(0)} chloroform monosolvate |
Authors of publication | bin Shawkataly, Omar; Khan, Imthyaz Ahmed; Yeap, Chin Sing; Fun, Hoong-Kun |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2010 |
Journal volume | 66 |
Journal issue | 1 |
Pages of publication | m90 - m91 |
a | 15.4916 ± 0.0006 Å |
b | 32.05 ± 0.0011 Å |
c | 21.1332 ± 0.0008 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 10492.8 ± 0.7 Å3 |
Cell temperature | 100 ± 0.1 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 7 |
Space group number | 29 |
Hermann-Mauguin space group symbol | P c a 21 |
Hall space group symbol | P 2c -2ac |
Residual factor for all reflections | 0.063 |
Residual factor for significantly intense reflections | 0.0428 |
Weighted residual factors for significantly intense reflections | 0.084 |
Weighted residual factors for all reflections included in the refinement | 0.0916 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
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The link is: https://www.crystallography.net/2224773.html
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