Information card for entry 2213467

Structure parameters

• Chemical name: catena-Poly[[diaquabis[(4-nitrophenylsulfinyl)acetato-κO]zinc(II)]- μ-4,4'-bipyridine-κ^2^N:N']
• Formula: C26 H24 N4 O12 S2 Zn
• Calculated formula: C26 H24 N4 O12 S2 Zn
• SMILES: [Zn](OC(=O)CS(=O)c1ccc(N(=O)=O)cc1)(OC(=O)CS(=O)c1ccc(N(=O)=O)cc1)([OH2])([OH2])[n]1ccc(cc1)c1cc[n](cc1)[Zn](OC(=O)CS(=O)c1ccc(N(=O)=O)cc1)(OC(=O)CS(=O)c1ccc(N(=O)=O)cc1)([OH2])([OH2])[n]1ccc(cc1)c1ccncc1
• Title of publication: <i>catena</i>-Poly[[diaquabis[(4-nitrophenylsulfinyl)acetato-κ<i>O</i>]zinc(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>']
• Authors of publication: Hou, Yan-Jun; Yu, Ying-Hui; 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: 5
• Pages of publication: m1530 - m1530
• a: 20.079 ± 0.004 Å
• b: 25.646 ± 0.005 Å
• c: 11.485 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 5914.2 ± 1.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0314
• Residual factor for significantly intense reflections: 0.0293
• Weighted residual factors for significantly intense reflections: 0.0755
• Weighted residual factors for all reflections included in the refinement: 0.0772
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes