Information card for entry 4349536

Structure parameters

• Formula: C14 H10 Co N2 Na O10
• Calculated formula: C14 H10 Co N2 Na O10
• SMILES: [Co]123(OC(=O)c4cccc(C(=O)O3)[n]14)OC(=O)c(ccc1)[n]2c1C(=O)[O-].[Na+].O.O
• 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: 14.0209 ± 0.001 Å
• b: 9.5023 ± 0.001 Å
• c: 12.8892 ± 0.001 Å
• α: 90°
• β: 113.564 ± 0.01°
• γ: 90°
• Cell volume: 1574 ± 0.3 ų
• Cell temperature: 173 ± 0.2 K
• Ambient diffraction temperature: 173 ± 0.2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0458
• Residual factor for significantly intense reflections: 0.0305
• Weighted residual factors for significantly intense reflections: 0.0695
• Weighted residual factors for all reflections included in the refinement: 0.0736
• Goodness-of-fit parameter for all reflections included in the refinement: 0.966
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No