Information card for entry 7006532

Structure parameters

• Chemical name: trans-hydrido-nitrosyl-tetrakis(trimethylphosphine)molybdenum(0)
• Formula: C12 H37 Mo N O P4
• Calculated formula: C12 H36 Mo N O P4
• SMILES: [MoH]([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)([P](C)(C)C)N=O
• Title of publication: Hydride transfer reactivity of tetrakis(trimethylphosphine)(hydrido)(nitrosyl)molybdenum(0).
• Authors of publication: Zhao, Yin; Schmalle, Helmut W.; Fox, Thomas; Blacque, Olivier; Berke, Heinz
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2006
• Journal issue: 1
• Pages of publication: 73 - 85
• a: 9.5261 ± 0.0007 Å
• b: 15.6484 ± 0.0015 Å
• c: 14.6607 ± 0.0011 Å
• α: 90°
• β: 98.876 ± 0.009°
• γ: 90°
• Cell volume: 2159.3 ± 0.3 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 6
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0469
• Residual factor for significantly intense reflections: 0.0337
• Weighted residual factors for significantly intense reflections: 0.0709
• Weighted residual factors for all reflections included in the refinement: 0.0737
• Goodness-of-fit parameter for all reflections included in the refinement: 0.882
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No