Information card for entry 4309999

Structure parameters

• Common name: Ru(DPPB-O2)2(DPPBT)
• Chemical name: Ru(DPPB-O2)2(DPPBT)
• Formula: C54 H42 O3 P3 Ru S3
• Calculated formula: C54 H42 O3 P3 Ru S3
• Title of publication: Oxygenation of a Ruthenium(II) Thiolate to a Ruthenium(II) Sulfinate Proceeds via Ruthenium(III)
• Authors of publication: Craig A. Grapperhaus; Selma Poturovic; Mark S. Mashuta
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 8185 - 8187
• a: 18.374 ± 0.003 Å
• b: 12.436 ± 0.002 Å
• c: 40.497 ± 0.006 Å
• α: 90°
• β: 99.995 ± 0.003°
• γ: 90°
• Cell volume: 9113 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.096
• Residual factor for significantly intense reflections: 0.069
• Weighted residual factors for significantly intense reflections: 0.107
• Weighted residual factors for all reflections included in the refinement: 0.128
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No