Information card for entry 4345060

Structure parameters

• Formula: C32 H66 Cl4 Co7 N16 O28
• Calculated formula: C32 H66 Cl4 Co7 N16 O28
• Title of publication: Heptanuclear Co(II)5Co(III)2 Cluster as Efficient Water Oxidation Catalyst.
• Authors of publication: Xu, Jia-Heng; Guo, Ling-Yu; Su, Hai-Feng; Gao, Xiang; Wu, Xiao-Fan; Wang, Wen-Guang; Tung, Chen-Ho; Sun, Di
• Journal of publication: Inorganic chemistry
• Year of publication: 2017
• Journal volume: 56
• Journal issue: 3
• Pages of publication: 1591 - 1598
• a: 11.723 ± 0.002 Å
• b: 23.448 ± 0.004 Å
• c: 12.93 ± 0.002 Å
• α: 90°
• β: 116.168 ± 0.0015°
• γ: 90°
• Cell volume: 3189.9 ± 0.9 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0711
• Residual factor for significantly intense reflections: 0.0556
• Weighted residual factors for significantly intense reflections: 0.1536
• Weighted residual factors for all reflections included in the refinement: 0.1702
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No