Information card for entry 4341185

Structure parameters

• Formula: C48 H40 Co4 K N16 O119 P5 W30
• Calculated formula: C48 H40 Co4 K N16 O119 P5 W30
• Title of publication: Anion-Induced Supramolecular Isomerism in Two Preyssler P5W30 Polyoxometalate-Based Hybrid Materials.
• Authors of publication: Zhao, Ya-Qin; Yu, Kai; Wang, Li-Wei; Wang, Ying; Wang, Xing-Po; Sun, Di
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 20
• Pages of publication: 11046 - 11050
• a: 18.9064 ± 0.0012 Å
• b: 20.9843 ± 0.0013 Å
• c: 23.4284 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 9294.9 ± 1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 8
• Space group number: 71
• Hermann-Mauguin space group symbol: I m m m
• Hall space group symbol: -I 2 2
• Residual factor for all reflections: 0.0618
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.1335
• Weighted residual factors for all reflections included in the refinement: 0.1436
• 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