Information card for entry 7232070

Structure parameters

• Formula: C12 H107 Cr2 Cu3 Mo12 N12 O71.5
• Calculated formula: C12 H107 Cr2 Cu3 Mo12 N12 O71.5
• Title of publication: A series of 0D to 3D Anderson-type polyoxometalate-based compounds obtained under ambient and hydrothermal conditions
• Authors of publication: Ying, Jun; Chen, Ya-Guang; Wang, Xiu-Yan
• Journal of publication: CrystEngComm
• Year of publication: 2019
• Journal volume: 21
• Journal issue: 7
• Pages of publication: 1168
• a: 27.6717 ± 0.0016 Å
• b: 13.4767 ± 0.0008 Å
• c: 22.8522 ± 0.0013 Å
• α: 90°
• β: 98.44 ± 0.001°
• γ: 90°
• Cell volume: 8429.8 ± 0.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 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: 0.0599
• Residual factor for significantly intense reflections: 0.0358
• Weighted residual factors for significantly intense reflections: 0.0754
• Weighted residual factors for all reflections included in the refinement: 0.0838
• Goodness-of-fit parameter for all reflections included in the refinement: 0.979
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No