Information card for entry 7700779

Structure parameters

• Formula: C66 H46 Co3 N8 O13
• Calculated formula: C66 H44 Co3 N8 O12
• Title of publication: Three 3D Co(ii) cluster-based MOFs constructed from polycarboxylate acids and bis(imidazole) ligands and their derivatives: magnetic properties and catalytic performance for the ORR.
• Authors of publication: Yang, Ming-Xing; Chen, Li-Juan; Ma, Rong; Cai, Jian-Nan; Shi, Yuan-De; Lin, Shen
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 35
• Pages of publication: 13369 - 13377
• a: 10.75 ± 0.002 Å
• b: 16.747 ± 0.004 Å
• c: 17.011 ± 0.004 Å
• α: 95.475 ± 0.002°
• β: 100.277 ± 0.003°
• γ: 101.979 ± 0.002°
• Cell volume: 2919.7 ± 1.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0722
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for significantly intense reflections: 0.0881
• Weighted residual factors for all reflections included in the refinement: 0.0934
• Goodness-of-fit parameter for all reflections included in the refinement: 0.91
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No