Information card for entry 7245177

Structure parameters

• Formula: C18 H16 Co N6 O6
• Calculated formula: C18 H16 Co N6 O6
• Title of publication: Influence of reaction temperature and stoichiometry on the coordination mode of a multidentate pyridylpyrazole ligand in Co(ii) complexes: from a 0D mononuclear structure to 3D frameworks
• Authors of publication: Zhang, Ling-Mei; Feng, Chao; Yang, Yu-Meng; Huang, Huan-Huan; Zhang, Guo-Ning; Wang, Yu-Cheng; Zhao, Hong
• Journal of publication: CrystEngComm
• Year of publication: 2022
• a: 10.8901 ± 0.0008 Å
• b: 8.7895 ± 0.0008 Å
• c: 19.6844 ± 0.0016 Å
• α: 90°
• β: 100.615 ± 0.001°
• γ: 90°
• Cell volume: 1851.9 ± 0.3 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: 0.0258
• Residual factor for significantly intense reflections: 0.0246
• Weighted residual factors for significantly intense reflections: 0.063
• Weighted residual factors for all reflections included in the refinement: 0.0636
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No