Information card for entry 4349989

Structure parameters

• Formula: C216 H160 Cu12 N8 O64
• Calculated formula: C216 H160 Cu12 N8 O64
• Title of publication: Amino-functionalized Cu-MOF for efficient purification of methane from light hydrocarbons and excellent catalytic performance
• Authors of publication: Wang, Xia; Zhang, Xiurong; Zhang, Kai; Wang, Xiaokang; Wang, Yutong; Fan, Weidong; Dai, Fangna
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2019
• Journal volume: 6
• Journal issue: 5
• Pages of publication: 1152
• a: 59.7742 ± 0.0015 Å
• b: 29.104 ± 0.0006 Å
• c: 13.6375 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 23724.7 ± 1.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 64
• Hermann-Mauguin space group symbol: C m c e
• Hall space group symbol: -C 2ac 2
• Residual factor for all reflections: 0.1219
• Residual factor for significantly intense reflections: 0.093
• Weighted residual factors for significantly intense reflections: 0.2668
• Weighted residual factors for all reflections included in the refinement: 0.2955
• Goodness-of-fit parameter for all reflections included in the refinement: 0.953
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No