Information card for entry 4320676

Structure parameters

• Chemical name: (hydridotris(pyrazolyl)borate)(triphenylphosphine) (carbonmonoxide)ruthenium(II) phenylamido
• Formula: C44.5 H43 B N7 O P Ru
• Calculated formula: C46 H47 B N7 O P Ru
• Title of publication: Preparation of the Octahedral d6Amido Complex TpRu(CO)(PPh3)(NHPh) (Tp = Hydridotris(pyrazolyl)borate): Solid-State Structural Characterization and Reactivity
• Authors of publication: K. N. Jayaprakash; T. Brent Gunnoe; Paul D. Boyle
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 6481 - 6486
• a: 12.0038 ± 0.0014 Å
• b: 22.169 ± 0.002 Å
• c: 14.9766 ± 0.0019 Å
• α: 90°
• β: 99.292 ± 0.015°
• γ: 90°
• Cell volume: 3933.2 ± 0.8 ų
• Cell temperature: 148 K
• Ambient diffraction temperature: 148 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: 0.037
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for all reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.039
• Goodness-of-fit parameter for significantly intense reflections: 1.4
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MolybdenumKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No