Information card for entry 1561199

Structure parameters

• Formula: C68 H48 Cu4 Mo10 N12 O42 P V4
• Calculated formula: C68 H48 Cu4 Mo10 N12 O42 P V4
• Title of publication: Two new POMOF compounds constructed from polyoxoanions, metals and organic ligands
• Authors of publication: Xiao, Li-Na; Zhang, Hao; Zhang, Ting-Ting; Zhang, Xiao; Cui, Xiao-Bing
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 2018
• Journal volume: 259
• Pages of publication: 11 - 18
• a: 10.8609 ± 0.0005 Å
• b: 14.1387 ± 0.0005 Å
• c: 15.5971 ± 0.0005 Å
• α: 65.951 ± 0.003°
• β: 89.811 ± 0.003°
• γ: 83.632 ± 0.003°
• Cell volume: 2171.36 ± 0.15 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0677
• Residual factor for significantly intense reflections: 0.0543
• Weighted residual factors for significantly intense reflections: 0.1396
• Weighted residual factors for all reflections included in the refinement: 0.1533
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No