Information card for entry 4324859

Structure parameters

• Formula: C18 H12 Cu N2 O5
• Calculated formula: C18 H12 Cu N2 O5
• Title of publication: Three-Dimensional Pillar-Layered Copper(II) Metal-Organic Framework with Immobilized Functional OH Groups on Pore Surfaces for Highly Selective CO2/CH4 and C2H2/CH4 Gas Sorption at Room Temperature
• Authors of publication: Zhenxia Chen; Shengchang Xiang; Hadi D. Arman; Jalal U. Mondal; Peng Li; Dongyuan Zhao; Banglin Chen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 3442 - 3446
• a: 21.073 ± 0.004 Å
• b: 13.061 ± 0.003 Å
• c: 11.123 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3061.4 ± 1.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 55
• Hermann-Mauguin space group symbol: P b a m
• Hall space group symbol: -P 2 2ab
• Residual factor for all reflections: 0.0995
• Residual factor for significantly intense reflections: 0.0932
• Weighted residual factors for significantly intense reflections: 0.2691
• Weighted residual factors for all reflections included in the refinement: 0.282
• Goodness-of-fit parameter for all reflections included in the refinement: 1.172
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No