Information card for entry 2235940

Structure parameters

• Chemical name: <i>catena</i>-Poly[[(1,10-phenanthroline)cobalt]-μ-2,4'-oxydibenzoato]
• Formula: C26 H16 Co N2 O5
• Calculated formula: C26 H16 Co N2 O5
• SMILES: [Co]123([O]=C(O1)c1c(Oc4ccc(C(=O)[O-])cc4)cccc1)([n]1cccc4ccc5c([n]2ccc5)c14)[O]=C(O3)c1ccc(Oc2ccccc2C2=[O][Co]3([n]4cccc5ccc6c([n]3ccc6)c45)O2)cc1
• Title of publication: <i>catena</i>-Poly[[(1,10-phenanthroline)cobalt]-μ-2,4'-oxydibenzoato]
• Authors of publication: Guo, Hai-Kang; Fu, Feng; Tang, Long; Hou, Xiang-Yang; Cao, Jia
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 8
• Pages of publication: m1078
• a: 7.8524 ± 0.0016 Å
• b: 15.345 ± 0.003 Å
• c: 18.778 ± 0.004 Å
• α: 90°
• β: 99.72 ± 0.03°
• γ: 90°
• Cell volume: 2230.2 ± 0.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1098
• Residual factor for significantly intense reflections: 0.0727
• Weighted residual factors for significantly intense reflections: 0.1248
• Weighted residual factors for all reflections included in the refinement: 0.1405
• Goodness-of-fit parameter for all reflections included in the refinement: 1.153
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes