Information card for entry 7115896

Structure parameters

• Formula: C45 H43 Ag3 Cl3 F18 N12 O5 Sb3
• Calculated formula: C45 H43 Ag3 Cl3 F18 N12 O5 Sb3
• Title of publication: A nanoporous Ag(I)-MOF showing unique selective adsorption of benzene among its organic analogues
• Authors of publication: Jun-Yan Cheng; Peng Wang; Jian-Ping Ma; Qi-Kui Liu; Yu-Bin Dong
• Journal of publication: Chem.Commun.
• Year of publication: 2014
• Journal volume: 50
• Pages of publication: 13672
• a: 15.9174 ± 0.0015 Å
• b: 15.9174 ± 0.0015 Å
• c: 44.26 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 9711.5 ± 1.8 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 8
• Space group number: 179
• Hermann-Mauguin space group symbol: P 65 2 2
• Hall space group symbol: P 65 2 (0 0 1)
• Residual factor for all reflections: 0.0694
• Residual factor for significantly intense reflections: 0.0646
• Weighted residual factors for significantly intense reflections: 0.1792
• Weighted residual factors for all reflections included in the refinement: 0.1855
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No