Information card for entry 2216686

Structure parameters

• Chemical name: catena-Poly[[diaqua(1,10-phenanthroline-κ^2^N,N')cobalt(II)]-μ-trans- stilbene-4,4'-dicarboxylato-κ^2^O:O']
• Formula: C28 H22 Co N2 O6
• Calculated formula: C28 H22 Co N2 O6
• SMILES: [Co]1([OH2])([OH2])([n]2cccc3ccc4ccc[n]1c4c23)OC(=O)c1ccc(cc1)/C=C/c1ccc(cc1)C(=O)O[Co]1([OH2])([OH2])(OC(=O)c2ccc(cc2)/C=C/c2ccc(cc2)C(=O)[O-])[n]2cccc3ccc4ccc[n]1c4c23
• Title of publication: <i>catena</i>-Poly[[diaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cobalt(II)]-μ-<i>trans</i>-stilbene-4,4'-dicarboxylato-κ^2^<i>O</i>:<i>O</i>']
• Authors of publication: Huan-Yu Wang; Shan Gao; Li-Hua Huo; Jing-Gui Zhao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 12
• Pages of publication: m3046 - m3047
• a: 7.5345 ± 0.0015 Å
• b: 9.2112 ± 0.0018 Å
• c: 18.524 ± 0.004 Å
• α: 88.12 ± 0.03°
• β: 84.29 ± 0.03°
• γ: 76.38 ± 0.03°
• Cell volume: 1243.2 ± 0.5 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0566
• Residual factor for significantly intense reflections: 0.0434
• Weighted residual factors for significantly intense reflections: 0.1353
• Weighted residual factors for all reflections included in the refinement: 0.1417
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes