Information card for entry 2210735

Structure parameters

• Chemical name: Hexakis(imidazole-κN^3^)cobalt(II) diformate
• Formula: C20 H26 Co N12 O4
• Calculated formula: C20 H26 Co N12 O4
• SMILES: c1[n]([Co]([n]2c[nH]cc2)([n]2c[nH]cc2)([n]2c[nH]cc2)([n]2c[nH]cc2)[n]2c[nH]cc2)cc[nH]1.O=C[O-].[O-]C=O
• Title of publication: Hexakis(imidazole-κ<i>N</i>^3^)cobalt(II) diformate
• Authors of publication: Lin, Jian-Li; Fei, Song-Ting; Lei, Ke-Wei; Zheng, Yue-Qing
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 10
• Pages of publication: m2439 - m2441
• a: 8.902 ± 0.0018 Å
• b: 16.916 ± 0.003 Å
• c: 8.325 ± 0.0017 Å
• α: 90°
• β: 91.72 ± 0.03°
• γ: 90°
• Cell volume: 1253.1 ± 0.4 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0595
• Residual factor for significantly intense reflections: 0.0401
• Weighted residual factors for significantly intense reflections: 0.0922
• Weighted residual factors for all reflections included in the refinement: 0.1013
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes