Information card for entry 7703326

Structure parameters

• Formula: C62 H47 Co3 N5 O14
• Calculated formula: C62 H47 Co3 N5 O14
• Title of publication: Combining unsaturated metal sites and narrow pores within a Co(ii)-based MOF towards CO₂ separation and transformation.
• Authors of publication: Zhang, Xiuling; Zhang, Ran-Hui; Hu, Hui; Geng, Longlong; Zhang, Yong-Zheng; Gao, Jun; Zhang, Da-Shuai; Jin, Yao-Qiang; Sheng, Jianmin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 7
• Pages of publication: 2058 - 2062
• a: 14.5845 ± 0.0014 Å
• b: 22.502 ± 0.002 Å
• c: 23.913 ± 0.002 Å
• α: 90°
• β: 96.025 ± 0.002°
• γ: 90°
• Cell volume: 7804.4 ± 1.2 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273.15 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: 0.089
• Residual factor for significantly intense reflections: 0.0549
• Weighted residual factors for significantly intense reflections: 0.1514
• Weighted residual factors for all reflections included in the refinement: 0.1699
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No