Information card for entry 1567160

Structure parameters

• Formula: C57 H36 Co N6 P
• Calculated formula: C57 H36 Co N6 P
• Title of publication: Electrocatalytic hydrogen production by CN– substituted cobalt triaryl corroles
• Authors of publication: Liu, Zheng-Yan; Lai, Jia-Wei; Yang, Gang; Ren, Bao-Ping; Lv, Zhou-Yan; Si, Li-Ping; Zhang, Hao; Liu, Hai-Yang
• Journal of publication: Catalysis Science & Technology
• Year of publication: 2022
• Journal volume: 12
• Journal issue: 16
• Pages of publication: 5125 - 5135
• a: 14.3899 ± 0.0007 Å
• b: 16.2551 ± 0.0008 Å
• c: 19.6213 ± 0.0009 Å
• α: 91.265 ± 0.002°
• β: 108.634 ± 0.002°
• γ: 94.679 ± 0.002°
• Cell volume: 4328.9 ± 0.4 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 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: 0.1385
• Residual factor for significantly intense reflections: 0.0812
• Weighted residual factors for significantly intense reflections: 0.1866
• Weighted residual factors for all reflections included in the refinement: 0.2263
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No