Information card for entry 4343605

Structure parameters

• Formula: C32 H26 Cd N12 O8
• Calculated formula: C32 H26 Cd N12 O8
• Title of publication: Carbon Dioxide Capture by a Metal-Organic Framework with Nitrogen-Rich Channels Based on Rationally Designed Triazole-Functionalized Tetraacid Organic Linker.
• Authors of publication: Seth, Saona; Savitha, Govardhan; Moorthy, Jarugu Narasimha
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 14
• Pages of publication: 6829 - 6835
• a: 18.066 ± 0.005 Å
• b: 20.762 ± 0.005 Å
• c: 15.24 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5716 ± 3 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 37
• Hermann-Mauguin space group symbol: C c c 2
• Hall space group symbol: C 2 -2c
• Residual factor for all reflections: 0.0906
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for significantly intense reflections: 0.1222
• Weighted residual factors for all reflections included in the refinement: 0.1378
• Goodness-of-fit parameter for all reflections included in the refinement: 0.897
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No