Information card for entry 7242571

Structure parameters

• Formula: C32 H46 Cu2 Ge N12 O48 W12
• Calculated formula: C32 H26.94 Cu2 Ge N12 O43.4 W12
• Title of publication: Improving the photocatalytic H2 evolution activity of Keggin polyoxometalates anchoring copper-azole complexes
• Authors of publication: Shen, Qingbo; Gómez-García, Carlos J.; Sun, Wenlong; Lai, Xiaoyong; Pang, Haijun; Ma, Huiyuan
• Journal of publication: Green Chemistry
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 8
• Pages of publication: 3104 - 3114
• a: 12.5419 ± 0.0005 Å
• b: 22.4521 ± 0.0009 Å
• c: 11.6246 ± 0.0005 Å
• α: 90°
• β: 109.951 ± 0.001°
• γ: 90°
• Cell volume: 3076.9 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 8
• Hermann-Mauguin space group symbol: C 1 m 1
• Hall space group symbol: C -2y
• Residual factor for all reflections: 0.0774
• Residual factor for significantly intense reflections: 0.0579
• Weighted residual factors for significantly intense reflections: 0.1378
• Weighted residual factors for all reflections included in the refinement: 0.1487
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No