Information card for entry 7056592

Structure parameters

• Formula: C36 H26 Cu7 Mo12 N18 O40 P
• Calculated formula: C36 H26 Cu7 Mo12 N18 O40 P
• Title of publication: Synthesis and photo-/electro-catalytic properties of Keggin polyoxometalate inorganic-organic hybrid layers based on d10 metal and rigid benzo-diazole/-triazole ligands
• Authors of publication: Cao, Yue; Lv, Jinghua; Yu, Kai; Wang, Chunmei; Su, Zhanhua; Wang, Lu; Zhou, Baibin
• Journal of publication: New J. Chem.
• Year of publication: 2017
• Journal volume: 41
• Journal issue: 21
• Pages of publication: 12459 - 12469
• a: 11.679 ± 0.01 Å
• b: 12.709 ± 0.012 Å
• c: 13.329 ± 0.012 Å
• α: 95.994 ± 0.013°
• β: 111.209 ± 0.013°
• γ: 107.347 ± 0.013°
• Cell volume: 1710 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0627
• Residual factor for significantly intense reflections: 0.0583
• Weighted residual factors for significantly intense reflections: 0.1082
• Weighted residual factors for all reflections included in the refinement: 0.1165
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No