Information card for entry 4131182

Structure parameters

• Formula: C76 H118 N8 O P2 V2
• Calculated formula: C76 H118 N8 O P1.9998 V2
• Title of publication: Phosphinidene Reactivity of a Transient Vanadium P≡N Complex.
• Authors of publication: Courtemanche, Marc-André; Transue, Wesley J.; Cummins, Christopher C.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2016
• Journal volume: 138
• Journal issue: 50
• Pages of publication: 16220 - 16223
• a: 29.333 ± 0.0012 Å
• b: 29.333 ± 0.0012 Å
• c: 23.124 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 17230.8 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0644
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.1411
• Weighted residual factors for all reflections included in the refinement: 0.1493
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No