Information card for entry 7228701

Structure parameters

• Formula: C27 H17 Co N6 O4.5
• Calculated formula: C27 H17 Co N6 O4.5
• Title of publication: Structural Diversity and Catalytic Properties of Five Co2(COO)4 Cluster Based Coordination Polymers Modified by R-isophthalic acid (R=H, NO2, CH3, OH and tBu)
• Authors of publication: Zhang, Jian-Yong; Shi, Jun-Xia; Cui, Peng-Hui; Yao, Zi-Jian; Deng, Wei
• Journal of publication: CrystEngComm
• Year of publication: 2017
• a: 24.1447 ± 0.0005 Å
• b: 13.0986 ± 0.0003 Å
• c: 16.033 ± 0.0004 Å
• α: 90°
• β: 97.903 ± 0.002°
• γ: 90°
• Cell volume: 5022.5 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0714
• Residual factor for significantly intense reflections: 0.0535
• Weighted residual factors for significantly intense reflections: 0.1378
• Weighted residual factors for all reflections included in the refinement: 0.148
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No