Information card for entry 2209775

Structure parameters

• Chemical name: Bis(acetato-κO)diaquabis(1-methylimidazole-κN^3^)cobalt(II)
• Formula: C12 H22 Co N4 O6
• Calculated formula: C12 H22 Co N4 O6
• SMILES: c1cn(c[n]1[Co]([n]1ccn(c1)C)(OC(=O)C)(OC(=O)C)([OH2])[OH2])C
• Title of publication: Bis(acetato-κ<i>O</i>)diaquabis(1-methylimidazole-κ<i>N</i>^3^)cobalt(II)
• Authors of publication: Blazěna Papánková; Svoboda, Ingrid; Fuess, Hartmut
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 8
• Pages of publication: m1916 - m1918
• a: 5.5832 ± 0.0007 Å
• b: 8.7122 ± 0.0007 Å
• c: 8.9572 ± 0.0008 Å
• α: 76.301 ± 0.007°
• β: 77.956 ± 0.009°
• γ: 72.629 ± 0.009°
• Cell volume: 399.5 ± 0.07 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0331
• Residual factor for significantly intense reflections: 0.0326
• Weighted residual factors for significantly intense reflections: 0.0868
• Weighted residual factors for all reflections included in the refinement: 0.0872
• Goodness-of-fit parameter for all reflections included in the refinement: 1.088
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes