Information card for entry 2215853

Structure parameters

• Chemical name: catena-Poly[[aqua(4,4'-bipyridine-κ^2^N,N')cobalt(II)]- μ-3-(4-carboxylatophenoxy)propionato-κ^3^O:O',O'']
• Formula: C20 H18 Co N2 O6
• Calculated formula: C20 H18 Co N2 O6
• SMILES: [Co]12(OC(=O)CCOc3ccc(cc3)C(=O)[O-])([OH2])([n]3ccccc3c3[n]1cccc3)[O]=C(O2)c1ccc(OCCC(=O)O[Co]2([OH2])[n]3ccccc3c3[n]2cccc3)cc1
• Title of publication: <i>catena</i>-Poly[[aqua(4,4'-bipyridine-κ^2^<i>N</i>,<i>N</i>')cobalt(II)]-μ-3-(4-carboxylatophenoxy)propionato-κ^3^<i>O</i>:<i>O</i>',<i>O</i>'']
• Authors of publication: Li-Li Kong; Shan Gao; Li-Hua Huo; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: m2852 - m2852
• a: 6.7193 ± 0.0002 Å
• b: 16.1369 ± 0.0005 Å
• c: 17.2762 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1873.24 ± 0.11 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0561
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.0747
• Weighted residual factors for all reflections included in the refinement: 0.0865
• Goodness-of-fit parameter for all reflections included in the refinement: 0.998
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes