Information card for entry 7110907

Structure parameters

• Common name: Co2DPD
• Formula: C79 H86 Cl2 Co2 N8 O3
• Calculated formula: C79 H86 Cl2 Co2 N8 O3
• Title of publication: Electrocatalytic four-electron reduction of oxygen to water by a highly flexible cofacial cobalt bisporphyrin
• Authors of publication: Chang, Christopher J.; Deng, Yongqi; Nocera, Daniel G.; Shi, Chunnian; Anson, Fred C.; Chang, C. K.
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 15
• Pages of publication: 1355
• a: 10.9872 ± 0.0002 Å
• b: 13.0824 ± 0.0002 Å
• c: 27.2127 ± 0.0001 Å
• α: 84.68°
• β: 87.285 ± 0.001°
• γ: 71.884 ± 0.001°
• Cell volume: 3700.9 ± 0.09 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1072
• Residual factor for significantly intense reflections: 0.0977
• Weighted residual factors for all reflections: 0.2889
• Weighted residual factors for significantly intense reflections: 0.2714
• Goodness-of-fit parameter for all reflections: 1.082
• Goodness-of-fit parameter for significantly intense reflections: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No