Information card for entry 4329765

Structure parameters

• Common name: bis(2-(diphenylphosphanyl)benzenethiolato) [2-(ethenylsulfanyl)phenyl] diphenylphosphine ruthenium(II)
• Chemical name: bis(2-(diphenylphosphanyl)benzenethiolato) [2-(ethenylsulfanyl)phenyl] diphenylphosphine ruthenium(II)
• Formula: C73.5 H61 P3 Ru S3
• Calculated formula: C73.5 H61 P3 Ru S3
• Title of publication: Selective and Reversible Base-Induced Elimination of a Ruthenium Dithioether Yields a Vinyl Metallosulfonium Complex
• Authors of publication: Rajat Chauhan; Mark S. Mashuta; Craig A. Grapperhaus
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 7913 - 7920
• a: 11.2718 ± 0.0005 Å
• b: 12.0524 ± 0.0003 Å
• c: 23.6075 ± 0.001 Å
• α: 101.715 ± 0.003°
• β: 98.154 ± 0.004°
• γ: 105.209 ± 0.003°
• Cell volume: 2965 ± 0.2 ų
• Cell temperature: 100.1 K
• Ambient diffraction temperature: 100.1 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0562
• Residual factor for significantly intense reflections: 0.0383
• Weighted residual factors for significantly intense reflections: 0.0763
• Weighted residual factors for all reflections included in the refinement: 0.0849
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No