Information card for entry 2219647

Structure parameters

• Chemical name: Diaquabis(4-bromo-2-formylphenolato-κ^2^O,O')cobalt(II)
• Formula: C14 H12 Br2 Co O6
• Calculated formula: C14 H12 Br2 Co O6
• SMILES: c12ccc(cc1C=[O][Co]1(O2)([O]=Cc2c(O1)ccc(c2)Br)([OH2])[OH2])Br
• Title of publication: Diaquabis(4-bromo-2-formylphenolato-κ^2^<i>O</i>,<i>O</i>')cobalt(II)
• Authors of publication: Xiao, Yu; Zhang, Min
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 10
• Pages of publication: m1231
• a: 29.527 ± 0.005 Å
• b: 4.7406 ± 0.0008 Å
• c: 11.6314 ± 0.0018 Å
• α: 90°
• β: 103.162 ± 0.003°
• γ: 90°
• Cell volume: 1585.3 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.051
• Residual factor for significantly intense reflections: 0.04
• Weighted residual factors for significantly intense reflections: 0.0895
• Weighted residual factors for all reflections included in the refinement: 0.0947
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes