Information card for entry 4346681

Structure parameters

• Formula: C49.5 H38 Co3 N4 O13
• Calculated formula: C49.5 H38 Co3 N4 O13
• Title of publication: Co(II)-MOF: A Highly Efficient Organic Oxidation Catalyst with Open Metal Sites.
• Authors of publication: Wang, Jian-Cheng; Ding, Feng-Wen; Ma, Jian-Ping; Liu, Qi-Kui; Cheng, Jun-Yan; Dong, Yu-Bin
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 22
• Pages of publication: 10865 - 10872
• a: 11.5791 ± 0.0004 Å
• b: 15.2623 ± 0.0006 Å
• c: 19.2483 ± 0.0009 Å
• α: 70.394 ± 0.004°
• β: 76.587 ± 0.003°
• γ: 82.732 ± 0.003°
• Cell volume: 3112.6 ± 0.2 ų
• Cell temperature: 100 ± 0.1 K
• Ambient diffraction temperature: 100 ± 0.1 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: 0.0781
• Residual factor for significantly intense reflections: 0.0552
• Weighted residual factors for significantly intense reflections: 0.1453
• Weighted residual factors for all reflections included in the refinement: 0.1544
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No