Information card for entry 2217910

Structure parameters

• Formula: C22 H16 Co N6 O2
• Calculated formula: C22 H16 Co N6 O2
• SMILES: C(=N[Co]12([n]3ccccc3c3cccc[n]13)(N=C=O)[n]1c(cccc1)c1cccc[n]21)=O
• Title of publication: <i>cis</i>-Bis(2,2'-bipyridyl)dicyanatocobalt(II)
• Authors of publication: Jia, LI; Kong, Ling-Qian; Li, Da-Cheng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 4
• Pages of publication: m582
• a: 14.148 ± 0.012 Å
• b: 9.774 ± 0.008 Å
• c: 15.253 ± 0.013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2109 ± 3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0861
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.0702
• Weighted residual factors for all reflections included in the refinement: 0.0778
• 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