Information card for entry 4333563

Structure parameters

• Formula: C8 H22 Cu3 Mo8 N16 O30
• Calculated formula: C8 H22 Cu3 Mo8 N16 O30
• Title of publication: Octamolybdate-Based Metal-Organic Framework with Unsaturated Coordinated Metal Center As Electrocatalyst for Generating Hydrogen from Water
• Authors of publication: Yun Gong; Tao Wu; Peng Gang Jiang; Jian Hua Lin; Yong Xi Yang
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 777 - 784
• a: 8.9318 ± 0.0008 Å
• b: 11.1272 ± 0.0009 Å
• c: 11.2538 ± 0.001 Å
• α: 116.636 ± 0.002°
• β: 100.877 ± 0.001°
• γ: 94.377 ± 0.001°
• Cell volume: 965.17 ± 0.15 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0343
• Residual factor for significantly intense reflections: 0.0284
• Weighted residual factors for significantly intense reflections: 0.0703
• Weighted residual factors for all reflections included in the refinement: 0.0737
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No