Information card for entry 7711528

Structure parameters

• Formula: C38 H33 Co2 N8 O9.5
• Calculated formula: C38 H33 Co2 N8 O9.5
• Title of publication: Five 3D Co(II)-MOFs constructed from 5-(2-methylimidazol-1-yl) isophthalic acid and different bis(imidazole) ligands and one of their derivatives as an efficient electrocatalyst for ORR
• Authors of publication: Yang, Ming-Xing; Yan, Rong-Zhi; Chen, Lijuan; Lin, Shen
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 10.1326 ± 0.0002 Å
• b: 12.8716 ± 0.0003 Å
• c: 14.319 ± 0.0004 Å
• α: 90°
• β: 91.03 ± 0.002°
• γ: 90°
• Cell volume: 1867.22 ± 0.08 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0458
• Residual factor for significantly intense reflections: 0.0376
• Weighted residual factors for significantly intense reflections: 0.0933
• Weighted residual factors for all reflections included in the refinement: 0.0984
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No