Information card for entry 4349535

Structure parameters

• Formula: C112 H82 Co8 Li8 N16 O81
• Calculated formula: C112 H82 Co8 Li8 N16 O81
• Title of publication: Anisotropic Li+ ion conductivity in a large single crystal of a Co(iii) coordination complex
• Authors of publication: Kim, Saet Byeol; Kim, Jeung Yoon; Jeong, Nak Cheon; Ok, Kang Min
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2017
• Journal volume: 4
• Journal issue: 1
• Pages of publication: 79
• a: 21.3041 ± 0.0003 Å
• b: 14.3738 ± 0.0002 Å
• c: 21.3818 ± 0.0003 Å
• α: 90°
• β: 92.286 ± 0.01°
• γ: 90°
• Cell volume: 6542.34 ± 0.17 ų
• Cell temperature: 173 ± 0.2 K
• Ambient diffraction temperature: 173 ± 0.2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.0739
• Residual factor for significantly intense reflections: 0.037
• Weighted residual factors for significantly intense reflections: 0.0738
• Weighted residual factors for all reflections included in the refinement: 0.0832
• Goodness-of-fit parameter for all reflections included in the refinement: 0.869
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No