Information card for entry 2211313

Structure parameters

• Chemical name: Diaquatetraethanolcobalt(II) sulfate
• Formula: C4 H20 Co O10 S
• Calculated formula: C4 H20 Co O10 S
• SMILES: C[OH][Co]([OH]C)([OH2])([OH]C)([OH]C)[OH2].O=S(=O)([O-])[O-]
• Title of publication: Diaquatetramethanolcobalt(II) sulfate
• Authors of publication: Zhu, Li-Na; Gao, Shan; Huo, Li-Hua; Zhao, Hui
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 12
• Pages of publication: m3401 - m3403
• a: 15.656 ± 0.002 Å
• b: 15.656 ± 0.002 Å
• c: 29.144 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 6186.4 ± 1.7 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 167
• Hermann-Mauguin space group symbol: R -3 c :H
• Hall space group symbol: -R 3 2"c
• Residual factor for all reflections: 0.0298
• Residual factor for significantly intense reflections: 0.0261
• Weighted residual factors for significantly intense reflections: 0.0769
• Weighted residual factors for all reflections included in the refinement: 0.0787
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes