Information card for entry 2225979

Structure parameters

• Chemical name: Undecacarbonyl-1κ^3^<i>C</i>,2κ^4^<i>C</i>,3κ^4^<i>C</i>-[tris(3- chlorophenyl)phosphine-1κ<i>P</i>]-<i>triangulo</i>-triruthenium(0)
• Formula: C29 H12 Cl3 O11 P Ru3
• Calculated formula: C29 H12 Cl3 O11 P Ru3
• SMILES: [Ru]1([Ru]([Ru]1(C#[O])(C#[O])(C#[O])C#[O])(C#[O])(C#[O])(C#[O])C#[O])([P](c1cc(Cl)ccc1)(c1cc(Cl)ccc1)c1cc(Cl)ccc1)(C#[O])(C#[O])C#[O]
• Title of publication: Undecacarbonyl-1κ^3^<i>C</i>,2κ^4^<i>C</i>,3κ^4^<i>C</i>-[tris(3-chlorophenyl)phosphine-1κ<i>P</i>]-<i>triangulo</i>-triruthenium(0)
• Authors of publication: bin Shawkataly, Omar; Pankhi, Mohd. Aslam A.; Yeap, Chin Sing; Fun, Hoong-Kun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 5
• Pages of publication: m581 - m582
• a: 21.8834 ± 0.0006 Å
• b: 17.106 ± 0.0005 Å
• c: 18.4776 ± 0.0005 Å
• α: 90°
• β: 107.766 ± 0.002°
• γ: 90°
• Cell volume: 6587 ± 0.3 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.056
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.0992
• Weighted residual factors for all reflections included in the refinement: 0.1107
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes