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Information card for entry 2224439
Preview
Coordinates | 2224439.cif |
---|---|
Structure factors | 2224439.hkl |
Original IUCr paper | HTML |
Chemical name | [μ-Bis(diphenylphosphino)methane-1:2κ^2^<i>P</i>:<i>P</i>']nonacarbonyl- 1κ^3^<i>C</i>,2κ^3^<i>C</i>,3κ^3^<i>C</i>-[tris(4- methylphenyl)arsine-3κ<i>As</i>]-<i>triangulo</i>-triruthenium(0) |
---|---|
Formula | C55 H43 As O9 P2 Ru3 |
Calculated formula | C55 H43 As O9 P2 Ru3 |
SMILES | [Ru]12([Ru]([Ru]1([As](c1ccc(cc1)C)(c1ccc(cc1)C)c1ccc(cc1)C)(C#[O])(C#[O])C#[O])([P](C[P]2(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O] |
Title of publication | [μ-Bis(diphenylphosphino)methane-1:2κ^2^<i>P</i>:<i>P</i>']nonacarbonyl-1κ^3^<i>C</i>,2κ^3^<i>C</i>,3κ^3^<i>C</i>-[tris(4-methylphenyl)arsine-3κ<i>As</i>]-<i>triangulo</i>-triruthenium(0) |
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 | 2009 |
Journal volume | 65 |
Journal issue | 12 |
Pages of publication | m1622 - m1623 |
a | 11.1241 ± 0.0001 Å |
b | 12.166 ± 0.0002 Å |
c | 20.0895 ± 0.0003 Å |
α | 91.406 ± 0.001° |
β | 101.116 ± 0.001° |
γ | 102.473 ± 0.001° |
Cell volume | 2598.63 ± 0.06 Å3 |
Cell temperature | 100 ± 0.1 K |
Ambient diffraction temperature | 100 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0529 |
Residual factor for significantly intense reflections | 0.0365 |
Weighted residual factors for significantly intense reflections | 0.0779 |
Weighted residual factors for all reflections included in the refinement | 0.0839 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.023 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2224439.html
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