Information card for entry 2229232

Structure parameters

• Chemical name: [μ-Bis(diphenylarsanyl)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>-[(4- methylsulfanylphenyl)diphenylphosphane-3κ<i>P</i>]-<i>triangulo</i>- triruthenium(0)
• Formula: C53 H39 As2 O9 P Ru3 S
• Calculated formula: C53 H39 As2 O9 P Ru3 S
• SMILES: [Ru]12([Ru]([Ru]1([P](c1ccccc1)(c1ccccc1)c1ccc(SC)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]
• Title of publication: [μ-Bis(diphenylarsanyl)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>-[(4-methylsulfanylphenyl)diphenylphosphane-3κ<i>P</i>]-<i>triangulo</i>-triruthenium(0)
• Authors of publication: bin Shawkataly, Omar; Khan, Imthyaz Ahmed; Hafiz Malik, H. A.; Yeap, Chin Sing; Fun, Hoong-Kun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 2
• Pages of publication: m179 - m180
• a: 16.107 ± 0.0011 Å
• b: 16.7244 ± 0.0012 Å
• c: 24.3147 ± 0.0013 Å
• α: 90°
• β: 129.712 ± 0.003°
• γ: 90°
• Cell volume: 5038.6 ± 0.6 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0483
• Residual factor for significantly intense reflections: 0.0318
• Weighted residual factors for significantly intense reflections: 0.0732
• Weighted residual factors for all reflections included in the refinement: 0.0806
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes