Information card for entry 4114043

Structure parameters

• Formula: C54 H68 B2 Cl F8 N Ni O P3
• Calculated formula: C54 H68 B2 Cl F8 N Ni O P3
• Title of publication: Hydrocarbation Chemistry Proceeding from Nickel Carbenes
• Authors of publication: Hongyi Hou; Peter K. Gantzel; Clifford P. Kubiak
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2003
• Journal volume: 125
• Pages of publication: 9564 - 9565
• a: 10.9342 ± 0.0016 Å
• b: 13.0238 ± 0.0019 Å
• c: 20.049 ± 0.003 Å
• α: 103.697 ± 0.003°
• β: 99.503 ± 0.003°
• γ: 95.084 ± 0.002°
• Cell volume: 2711.4 ± 0.7 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 9
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0933
• Residual factor for significantly intense reflections: 0.0685
• Weighted residual factors for significantly intense reflections: 0.1836
• Weighted residual factors for all reflections included in the refinement: 0.197
• Goodness-of-fit parameter for all reflections included in the refinement: 1.123
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No