Information card for entry 2214327

Structure parameters

• Chemical name: <i>catena</i>-Poly[[diaquabis[(4-chlorophenylsulfinyl)acetato- κ<i>O</i>]nickel(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>']
• Formula: C26 H24 Cl2 N2 Ni O8 S2
• Calculated formula: C26 H24 Cl2 N2 Ni O8 S2
• SMILES: [Ni](OC(=O)CS(=O)c1ccc(Cl)cc1)(OC(=O)CS(=O)c1ccc(Cl)cc1)([OH2])([OH2])[n]1ccc(cc1)c1cc[n](cc1)[Ni](OC(=O)CS(=O)c1ccc(Cl)cc1)(OC(=O)CS(=O)c1ccc(Cl)cc1)([OH2])([OH2])[n]1ccc(c2ccncc2)cc1
• Title of publication: <i>catena</i>-Poly[[diaquabis[(4-chlorophenylsulfinyl)acetato-κ<i>O</i>]nickel(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>']
• Authors of publication: Su, Yu; Hou, Yan-Jun; Sun, Zhi-Zhong; Li, Bai-Yan; Hou, Guang-Feng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 7
• Pages of publication: m1970 - m1970
• a: 20.269 ± 0.004 Å
• b: 25.503 ± 0.006 Å
• c: 11.345 ± 0.011 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5864 ± 6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.0343
• Residual factor for significantly intense reflections: 0.0306
• Weighted residual factors for significantly intense reflections: 0.069
• Weighted residual factors for all reflections included in the refinement: 0.0708
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes