Information card for entry 2220083

Structure parameters

• Chemical name: Bis(μ-biphenyl-2,2'-dicarboxylato)bis[(2,2'-bipyridine)cobalt(II)]
• Formula: C48 H32 Co2 N4 O8
• Calculated formula: C48 H32 Co2 N4 O8
• SMILES: C1(=O)c2ccccc2c2c(C(=O)O[Co]3([n]4ccccc4c4[n]3cccc4)OC(=O)c3ccccc3c3c(C(=O)O[Co]4([n]5ccccc5c5[n]4cccc5)O1)cccc3)cccc2
• Title of publication: Bis(μ-biphenyl-2,2'-dicarboxylato)bis[(2,2'-bipyridine)cobalt(II)]
• Authors of publication: An, Zhe; Niu, Xian-Chun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: m1556
• a: 11.236 ± 0.002 Å
• b: 13.198 ± 0.002 Å
• c: 13.393 ± 0.002 Å
• α: 90°
• β: 102.9 ± 0.02°
• γ: 90°
• Cell volume: 1936 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0527
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.0843
• Weighted residual factors for all reflections included in the refinement: 0.0932
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes