Information card for entry 4060149

Structure parameters

• Formula: C21 H15 Mo O6 P
• Calculated formula: C21 H15 Mo O6 P
• Title of publication: Reaction of Terminal Phosphinidene Complexes with Acetylenic Alcohols: Intramolecular Hydrophospination of a Phosphirene Ring.
• Authors of publication: Irina Kalinina, Bruno Donnadieu, Francois Mathey
• Journal of publication: Organometallics
• Year of publication: 2005
• a: 8.4327 ± 0.0006 Å
• b: 10.8085 ± 0.0008 Å
• c: 11.9867 ± 0.001 Å
• α: 79.068 ± 0.005°
• β: 76.955 ± 0.005°
• γ: 79.595 ± 0.005°
• Cell volume: 1034.12 ± 0.14 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 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: 0.0713
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.0868
• Weighted residual factors for all reflections included in the refinement: 0.0975
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No