Information card for entry 7228072

Structure parameters

• Formula: C40 H66 As2 Cu2 Mo6 N24 O27
• Calculated formula: C40 H64 As2 Cu2 Mo6 N24 O27
• Title of publication: Assembly of Six [HxAs2Mo6O26](6-x)- Clusters-Based Hybrid Materials from 1D Chain to 3D Framework with Multiple Cu-N Complexes
• Authors of publication: Cong, Bowen; Su, Zhanhua; Zhao, Zhifeng; yu, baoyi; Zhao, Wenqi; Xia, Lin; ma, xiujuan; Zhou, Baibin
• Journal of publication: CrystEngComm
• Year of publication: 2017
• a: 12.5599 ± 0.0015 Å
• b: 12.7481 ± 0.0015 Å
• c: 13.367 ± 0.0016 Å
• α: 99.749 ± 0.001°
• β: 105.537 ± 0.001°
• γ: 111.878 ± 0.001°
• Cell volume: 1824.8 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 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: 0.0423
• Residual factor for significantly intense reflections: 0.0385
• Weighted residual factors for significantly intense reflections: 0.1044
• Weighted residual factors for all reflections included in the refinement: 0.1075
• Goodness-of-fit parameter for all reflections included in the refinement: 1.069
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No