Information card for entry 2229069

Structure parameters

• Chemical name: [μ-Bis(di-<i>o</i>-tolylphosphanyl)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>- [diphenyl(phenylsulfanylmethyl)phosphane-3κ<i>P</i>]-<i>triangulo</i>- triruthenium(0) dichloromethane 0.25-solvate
• Formula: C57.25 H47.5 Cl0.5 O9 P3 Ru3 S
• Calculated formula: C57.25 H47.5 Cl0.5 O9 P3 Ru3 S
• Title of publication: [μ-Bis(di-<i>o</i>-tolylphosphanyl)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>-[diphenyl(phenylsulfanylmethyl)phosphane-3κ<i>P</i>]-<i>triangulo</i>-triruthenium(0) dichloromethane 0.25-solvate
• 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: m195 - m196
• a: 11.022 ± 0.002 Å
• b: 28.576 ± 0.006 Å
• c: 18.454 ± 0.004 Å
• α: 90°
• β: 106.069 ± 0.003°
• γ: 90°
• Cell volume: 5585 ± 2 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: 0.0772
• Residual factor for significantly intense reflections: 0.0397
• Weighted residual factors for significantly intense reflections: 0.0764
• Weighted residual factors for all reflections included in the refinement: 0.0921
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes