Information card for entry 4346219

Structure parameters

• Formula: C21 H11.83 N O9.42 Zn2
• Calculated formula: C21 H11.34 N O9.41667 Zn2
• Title of publication: Two nanocage-based metal-organic frameworks with mixed-cluster SBUs and CO2 sorption selectivity.
• Authors of publication: Liu, Bo; Wu, Wei-Ping; Hou, Lei; Li, Zhi-Sen; Wang, Yao-Yu
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 18
• Pages of publication: 8937 - 8942
• a: 27.468 ± 0.003 Å
• b: 27.468 Å
• c: 27.468 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 20724 ± 2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 229
• Hermann-Mauguin space group symbol: I m -3 m
• Hall space group symbol: -I 4 2 3
• Residual factor for all reflections: 0.1029
• Residual factor for significantly intense reflections: 0.0961
• Weighted residual factors for significantly intense reflections: 0.2155
• Weighted residual factors for all reflections included in the refinement: 0.2189
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No