Information card for entry 4503213

Structure parameters

• Formula: C60 H58 Co3 N12 O17
• Calculated formula: C60 H52 Co3 N12 O17
• Title of publication: Hydrothermal Synthesis of Metal−Organic Frameworks Based on Aromatic Polycarboxylate and Flexible Bis(imidazole) Ligands
• Authors of publication: Qi, Yan; Luo, Feng; Che, Yunxia; Zheng, Jimin
• Journal of publication: Crystal Growth & Design
• Year of publication: 2008
• Journal volume: 8
• Journal issue: 2
• Pages of publication: 606
• a: 14.178 ± 0.003 Å
• b: 10.118 ± 0.002 Å
• c: 20.936 ± 0.004 Å
• α: 90°
• β: 99.79 ± 0.03°
• γ: 90°
• Cell volume: 2959.6 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1015
• Residual factor for significantly intense reflections: 0.0533
• Weighted residual factors for significantly intense reflections: 0.1139
• Weighted residual factors for all reflections included in the refinement: 0.132
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No