Information card for entry 4349878

Structure parameters

• Formula: C20.5 H11.83 F In1.5 O7.67
• Calculated formula: C20.5 H11.8334 F In1.5 O7.6667
• Title of publication: A fluorine-functionalized microporous In-MOF with high physicochemical stability for light hydrocarbon storage and separation
• Authors of publication: Fan, Weidong; Liu, Xiuping; Wang, Xia; Li, Yue; Xing, Chengyong; Wang, Yutong; Guo, Wenyue; Zhang, Liangliang; Sun, Daofeng
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2018
• Journal volume: 5
• Journal issue: 10
• Pages of publication: 2445
• a: 27.3963 ± 0.0013 Å
• b: 27.3963 ± 0.0013 Å
• c: 75.861 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 49310 ± 4 ų
• Cell temperature: 150.01 ± 0.1 K
• Ambient diffraction temperature: 150.01 ± 0.1 K
• Number of distinct elements: 5
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.108
• Residual factor for significantly intense reflections: 0.0843
• Weighted residual factors for significantly intense reflections: 0.2674
• Weighted residual factors for all reflections included in the refinement: 0.2989
• Goodness-of-fit parameter for all reflections included in the refinement: 1.092
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No