Information card for entry 2222393

Structure parameters

• Chemical name: poly[0.35-[hexaaquacobalt(II)] [tri-μ-hydroxido-μ-sulfato-dicobalt(II)]]
• Formula: Co2.35 H7.2 O9.1 S
• Calculated formula: Co2.35 H7.2 O9.1 S
• SMILES: [Co]([OH2])([OH2])([OH2])([OH2])([OH2])[OH2].[Co+3].[Co+3].[OH-].[OH-].[OH-].S(=O)(=O)([O-])[O-]
• Title of publication: Intercalated brucite-type layered cobalt(II) hydroxysulfate
• Authors of publication: Yotnoi, Bunlawee; Luachan, Sanchai; Prior, Timothy J.; Rujiwatra, Apinpus
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 7
• Pages of publication: i52
• a: 6.3627 ± 0.0019 Å
• b: 6.3627 ± 0.0019 Å
• c: 12.18 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 427 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 164
• Hermann-Mauguin space group symbol: P -3 m 1
• Hall space group symbol: -P 3 2"
• Residual factor for all reflections: 0.0666
• Residual factor for significantly intense reflections: 0.0481
• Weighted residual factors for significantly intense reflections: 0.1242
• Weighted residual factors for all reflections included in the refinement: 0.1318
• Goodness-of-fit parameter for all reflections included in the refinement: 0.902
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes