Information card for entry 7231886

Structure parameters

• Formula: C12 H78 Cu4 Mo10 N12 O65 P4
• Calculated formula: C12 H40 Cu4 Mo10 N12 O65 P4
• Title of publication: A binuclear copper-substituted phosphomolybdate with reactive oxygen species catalytic ability and antimicrobial activity
• Authors of publication: Ma, Xiang; Zhang, Chao; Hua, Jiai; Ma, Pengtao; Wang, Jingping; Niu, Jingyang
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 3
• Pages of publication: 394
• a: 28.685 ± 0.012 Å
• b: 18.298 ± 0.008 Å
• c: 18.24 ± 0.008 Å
• α: 90°
• β: 122.743 ± 0.006°
• γ: 90°
• Cell volume: 8053 ± 6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0345
• Residual factor for significantly intense reflections: 0.0321
• Weighted residual factors for significantly intense reflections: 0.0877
• Weighted residual factors for all reflections included in the refinement: 0.0893
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No