Information card for entry 4506927

Structure parameters

• Formula: C45 H34 Co2 N4 O12
• Calculated formula: C45 H34 Co2 N4 O12
• Title of publication: Construction of Three-Dimensional Cobalt(II)-Based Metal‒Organic Frameworks by Synergy between Rigid and Semirigid Ligands
• Authors of publication: Yang, Weiting; Guo, Min; Yi, Fei-Yan; Sun, Zhong-Ming
• Journal of publication: Crystal Growth & Design
• Year of publication: 2012
• Journal volume: 12
• Journal issue: 11
• Pages of publication: 5529
• a: 20.131 ± 0.002 Å
• b: 24.767 ± 0.003 Å
• c: 26.928 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 13426 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.1473
• Residual factor for significantly intense reflections: 0.1002
• Weighted residual factors for significantly intense reflections: 0.2857
• Weighted residual factors for all reflections included in the refinement: 0.307
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No