Information card for entry 1519699

Structure parameters

• Formula: C40 H46 Cl8 Co5 N18
• Calculated formula: C40 H46 Cl8 Co5 N18
• Title of publication: A series of multidimensional MOFs incorporating a new N-heterocyclic building block: 5,5′-di(pyridin-4-yl)-3,3′-bi(1,2,4-triazole)
• Authors of publication: Yao, Peng-Fei; Li, Hai-Ye; Huang, Fu-Ping; Yu, Qing; Qin, Xao-Huan; Tang, Jie; Tao, Ye; Bian, He-Dong
• Journal of publication: RSC Advances
• Year of publication: 2015
• Journal volume: 5
• Journal issue: 60
• Pages of publication: 48596 - 48606
• a: 11.5936 ± 0.0006 Å
• b: 11.9201 ± 0.0007 Å
• c: 12.1223 ± 0.0006 Å
• α: 63.593 ± 0.005°
• β: 88.025 ± 0.004°
• γ: 67.331 ± 0.005°
• Cell volume: 1365.41 ± 0.16 ų
• Cell temperature: 299.4 ± 0.7 K
• Ambient diffraction temperature: 299.4 ± 0.7 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: 0.1097
• Residual factor for significantly intense reflections: 0.0652
• Weighted residual factors for significantly intense reflections: 0.1246
• Weighted residual factors for all reflections included in the refinement: 0.1433
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No