Information card for entry 7243548

Structure parameters

• Formula: C60 H40 Co3 N6 O14
• Calculated formula: C60 H40 Co3 N6 O14
• Title of publication: Structures and catalytic oxidative coupling reaction of four Co-MOFs modified with R-isophthalic acid (RH, OH and COOH) and trigonal ligands
• Authors of publication: Liu, Qing; Zhang, Lin-Yan; Bao, Yu-Mei; Zhang, Na; Zhang, Jian-Yong; Xing, Yuan-Yuan; Deng, Wei; Liu, Zhen-Jiang
• Journal of publication: CrystEngComm
• Year of publication: 2021
• Journal volume: 23
• Journal issue: 43
• Pages of publication: 7590 - 7601
• a: 10.1206 ± 0.0003 Å
• b: 13.677 ± 0.0005 Å
• c: 15.8965 ± 0.0005 Å
• α: 70.383 ± 0.001°
• β: 78.221 ± 0.001°
• γ: 83.458 ± 0.001°
• Cell volume: 2026.56 ± 0.12 ų
• Cell temperature: 297 K
• Ambient diffraction temperature: 297 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: 0.0293
• Residual factor for significantly intense reflections: 0.0269
• Weighted residual factors for significantly intense reflections: 0.0853
• Weighted residual factors for all reflections included in the refinement: 0.087
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No