Information card for entry 2213338

Structure parameters

• Chemical name: Tetraaquabis[2-(4-pyridyl)ethanesulfonato-κN]cobalt(II)
• Formula: C14 H24 Co N2 O10 S2
• Calculated formula: C14 H24 Co N2 O10 S2
• SMILES: c1cc(cc[n]1[Co]([OH2])([OH2])([n]1ccc(cc1)CCS(=O)(=O)[O-])([OH2])[OH2])CCS(=O)(=O)[O-]
• Title of publication: Tetraaquabis[2-(4-pyridyl)ethanesulfonato-κ<i>N</i>]cobalt(II)
• Authors of publication: Qi Zhang; Jian Gong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 5
• Pages of publication: m1300 - m1301
• a: 9.1469 ± 0.0008 Å
• b: 8.7961 ± 0.0007 Å
• c: 12.491 ± 0.001 Å
• α: 90°
• β: 94.965 ± 0.001°
• γ: 90°
• Cell volume: 1001.22 ± 0.14 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.03
• Residual factor for significantly intense reflections: 0.024
• Weighted residual factors for significantly intense reflections: 0.0621
• Weighted residual factors for all reflections included in the refinement: 0.0662
• Goodness-of-fit parameter for all reflections included in the refinement: 1.115
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes