Information card for entry 2224086

Structure parameters

• Chemical name: Bis[2-(2-pyridylmethyleneamino)benzenesulfonato- κ^3^<i>N</i>,<i>N</i>',<i>O</i>]cobalt(II) dihydrate
• Formula: C24 H22 Co N4 O8 S2
• Calculated formula: C24 H22 Co N4 O8 S2
• SMILES: O.c1c[n]2[Co]345([N](c6c(cccc6)S(=O)(=O)O4)=Cc2cc1)[N](c1c(cccc1)S(=O)(=O)O5)=Cc1cccc[n]31.O
• Title of publication: Bis[2-(2-pyridylmethyleneamino)benzenesulfonato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]cobalt(II) dihydrate
• Authors of publication: Huang, Xue-Ren; Ou-Yang, Miao; Yang, Ge-Ge; Meng, Xiu-Jin; Jiang, Yi-Min
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 11
• Pages of publication: m1465
• a: 19.636 ± 0.002 Å
• b: 8.0973 ± 0.0008 Å
• c: 16.2819 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2588.8 ± 0.4 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 6
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0429
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for significantly intense reflections: 0.0816
• Weighted residual factors for all reflections included in the refinement: 0.0885
• Goodness-of-fit parameter for all reflections included in the refinement: 1.023
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes