Information card for entry 4129528

Structure parameters

• Formula: C314 H583 Cu18 N104 O151 Zn23
• Calculated formula: C90 H36 Cu18 N54 O71 Zn20
• Title of publication: Heterogeneity within a Mesoporous Metal-Organic Framework with Three Distinct Metal-Containing Building Units.
• Authors of publication: Tu, Binbin; Pang, Qingqing; Ning, Erlong; Yan, Wenqing; Qi, Yi; Wu, Doufeng; Li, Qiaowei
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2015
• Journal volume: 137
• Journal issue: 42
• Pages of publication: 13456 - 13459
• a: 62.3023 ± 0.0012 Å
• b: 62.3023 ± 0.0012 Å
• c: 62.3023 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 241831 ± 8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 225
• Hermann-Mauguin space group symbol: F m -3 m
• Hall space group symbol: -F 4 2 3
• Residual factor for all reflections: 0.084
• Residual factor for significantly intense reflections: 0.0721
• Weighted residual factors for significantly intense reflections: 0.2133
• Weighted residual factors for all reflections included in the refinement: 0.2191
• Goodness-of-fit parameter for all reflections included in the refinement: 1.361
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No