Information card for entry 2211210

Structure parameters

• Chemical name: Bis[2-(2-pyridylmethylamino)ethanesulfonato-κ^3^N,N',O]cobalt(II)
• Formula: C16 H22 Co N4 O6 S2
• Calculated formula: C16 H22 Co N4 O6 S2
• SMILES: c1cccc2[n]1[Co]134([n]5ccccc5C[NH]1CCS(=O)(=O)O4)[NH](C2)CCS(=O)(=O)O3
• Title of publication: Bis[2-(2-pyridylmethylamino)ethanesulfonato-κ^3^<i>N</i>,<i>N</i>',<i>O</i>]cobalt(II)
• Authors of publication: Jun-Xia Li; Yi-Min Jiang; Hai-Ye Li
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 11
• Pages of publication: m2984 - m2986
• a: 9.6066 ± 0.0012 Å
• b: 9.9919 ± 0.0012 Å
• c: 11.4099 ± 0.0014 Å
• α: 90°
• β: 106.127 ± 0.001°
• γ: 90°
• Cell volume: 1052.1 ± 0.2 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 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: 0.0264
• Residual factor for significantly intense reflections: 0.0232
• Weighted residual factors for significantly intense reflections: 0.0594
• Weighted residual factors for all reflections included in the refinement: 0.0613
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes