Information card for entry 2206762

Structure parameters

• Chemical name: diaquabis(vanillinato-κ^2^O,O')cobalt(II)
• Formula: C16 H18 Co O8
• Calculated formula: C16 H18 Co O8
• SMILES: c1(cc2c(cc1)O[Co]1([OH2])([O]2C)([OH2])[O](c2cc(ccc2O1)C=O)C)C=O
• Title of publication: Redetermination of diaquabis(vanillinato-κ^2^<i>O</i>,<i>O</i>')cobalt(II)
• Authors of publication: Dong-Dong Lin; Duan-Jun Xu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 9
• Pages of publication: m1821 - m1822
• a: 22.27 ± 0.002 Å
• b: 10.4487 ± 0.0012 Å
• c: 7.7771 ± 0.0009 Å
• α: 90°
• β: 107.249 ± 0.012°
• γ: 90°
• Cell volume: 1728.3 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• 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: 0.036
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.082
• Weighted residual factors for all reflections included in the refinement: 0.084
• Goodness-of-fit parameter for all reflections included in the refinement: 1.087
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes