Information card for entry 7061165

Structure parameters

• Formula: B18 H56 O80 V12
• Calculated formula: B18 H56 O80 V12
• Title of publication: Water assisted high proton conductance in a pure-inorganic framework vanadoborate
• Authors of publication: Liu, Xinxin; Zhang, Le; Zhao, SiSi; Guo, Biao; Zhao, Zhen
• Journal of publication: New Journal of Chemistry
• Year of publication: 2022
• Journal volume: 46
• Journal issue: 3
• Pages of publication: 974 - 980
• a: 18.968 ± 0.004 Å
• b: 18.443 ± 0.004 Å
• c: 19.815 ± 0.004 Å
• α: 90°
• β: 92.77 ± 0.03°
• γ: 90°
• Cell volume: 6924 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.0868
• Residual factor for significantly intense reflections: 0.0631
• Weighted residual factors for significantly intense reflections: 0.1602
• Weighted residual factors for all reflections included in the refinement: 0.1753
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No