Information card for entry 7228290

Structure parameters

• Formula: C46 H38 Mn2 N6 O10
• Calculated formula: C46 H38 Mn2 N6 O10
• Title of publication: Four new coordination polymers based on a pyridinetetracarboxylate ligand: Syntheses, structures and high CO2/CH4 separation
• Authors of publication: Ding, Tao; Wang, Xiao-Xian; Zhang, Meng; Ou, Si-Meng; Hu, Tian-Ju
• Journal of publication: CrystEngComm
• Year of publication: 2017
• a: 9.7601 ± 0.0019 Å
• b: 10.129 ± 0.002 Å
• c: 13.161 ± 0.003 Å
• α: 103.634 ± 0.004°
• β: 90.513 ± 0.004°
• γ: 95.06 ± 0.004°
• Cell volume: 1258.9 ± 0.5 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0917
• Residual factor for significantly intense reflections: 0.0813
• Weighted residual factors for significantly intense reflections: 0.2272
• Weighted residual factors for all reflections included in the refinement: 0.2362
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No