Information card for entry 2229230

Structure parameters

• Chemical name: [μ-Bis(diphenylphosphanyl)ethane-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- (methoxyphenyl)arsane-3κ<i>As</i>]-<i>triangulo</i>-triruthenium(0) chloroform monosolvate
• Formula: C57 H46 As Cl3 O12 P2 Ru3
• Calculated formula: C57 H46 As Cl3 O12 P2 Ru3
• SMILES: [Ru]12([Ru]([Ru]1([As](c1ccc(OC)cc1)(c1ccc(OC)cc1)c1ccc(OC)cc1)(C#[O])(C#[O])C#[O])([P](CC[P]2(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O].ClC(Cl)Cl
• Title of publication: [μ-Bis(diphenylphosphanyl)ethane-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-(methoxyphenyl)arsane-3κ<i>As</i>]-<i>triangulo</i>-triruthenium(0) chloroform monosolvate
• Authors of publication: bin Shawkataly, Omar; Khan, Imthyaz Ahmed; Sirat, Siti Syaida; 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: m175 - m176
• a: 13.1097 ± 0.0002 Å
• b: 19.8034 ± 0.0004 Å
• c: 22.5603 ± 0.0004 Å
• α: 90°
• β: 98.689 ± 0.001°
• γ: 90°
• Cell volume: 5789.81 ± 0.18 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: 0.1003
• Residual factor for significantly intense reflections: 0.067
• Weighted residual factors for significantly intense reflections: 0.0992
• Weighted residual factors for all reflections included in the refinement: 0.1081
• Goodness-of-fit parameter for all reflections included in the refinement: 1.11
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes