Information card for entry 7040492

Structure parameters

• Formula: C102.5 H193.5 N4.5 O100.5 V28
• Calculated formula: C84 H139.999 O100 V28
• Title of publication: Synthesis, structures, and magnetic properties of metal-organic polyhedra based on unprecedented {V7} isopolyoxometalate clusters.
• Authors of publication: Zhang, Yu-Teng; Li, Shuang-Bao; Wang, Xin-Long; Gong, Ya-Ru; Shao, Kui-Zhan; Su, Zhong-Min
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 38
• Pages of publication: 14898 - 14901
• a: 21.911 ± 0.005 Å
• b: 21.911 ± 0.005 Å
• c: 21.911 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 10519 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 217
• Hermann-Mauguin space group symbol: I -4 3 m
• Hall space group symbol: I -4 2 3
• Residual factor for all reflections: 0.057
• Residual factor for significantly intense reflections: 0.0435
• Weighted residual factors for significantly intense reflections: 0.0901
• Weighted residual factors for all reflections included in the refinement: 0.0951
• Goodness-of-fit parameter for all reflections included in the refinement: 1.015
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No