Information card for entry 4127201

Structure parameters

• Formula: C33.54 H32.42 F6 N4 Ni
• Calculated formula: C33.542 H32.416 F6 N4 Ni
• Title of publication: Catalytic Azoarene Synthesis from Aryl Azides Enabled by a Dinuclear Ni Complex.
• Authors of publication: Powers, Ian G.; Andjaba, John M.; Luo, Xuyi; Mei, Jianguo; Uyeda, Christopher
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2018
• a: 16.3481 ± 0.0003 Å
• b: 22.1973 ± 0.0004 Å
• c: 35.036 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 12714 ± 0.4 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.061
• Residual factor for significantly intense reflections: 0.0444
• Weighted residual factors for significantly intense reflections: 0.1098
• Weighted residual factors for all reflections included in the refinement: 0.1183
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No