Information card for entry 4350243

Structure parameters

• Formula: C39 H38 Mo O P2
• Calculated formula: C39 H25 Mo O P2
• Title of publication: Synthesis and structure of CpMo(CO)(dppe)H and its oxidation by Ph3C+.
• Authors of publication: Cheng, Tan-Yun; Szalda, David J.; Zhang, Jie; Bullock, R. Morris
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 12
• Pages of publication: 4712 - 4720
• a: 10.83 ± 0.003 Å
• b: 11.307 ± 0.003 Å
• c: 14.309 ± 0.004 Å
• α: 96.65 ± 0.02°
• β: 105.5 ± 0.02°
• γ: 96.43 ± 0.02°
• Cell volume: 1658.3 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.2393
• Residual factor for significantly intense reflections: 0.0579
• Weighted residual factors for significantly intense reflections: 0.1196
• Weighted residual factors for all reflections included in the refinement: 0.1578
• Goodness-of-fit parameter for all reflections included in the refinement: 0.945
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No