Information card for entry 2234673

Structure parameters

• Chemical name: Diaquabis(1-methyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)bis[2-(naphthalen- 1-yl)acetato-κ<i>O</i>]cobalt(II)
• Formula: C32 H34 Co N4 O6
• Calculated formula: C32 H34 Co N4 O6
• SMILES: O=C(O[Co]([n]1ccn(c1)C)([n]1ccn(c1)C)(OC(=O)Cc1cccc2c1cccc2)([OH2])[OH2])Cc1cccc2c1cccc2
• Title of publication: Diaquabis(1-methyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)bis[2-(naphthalen-1-yl)acetato-κ<i>O</i>]cobalt(II)
• Authors of publication: Zhao, Hong; Yin, Fu-Jun; Xu, Xing-You; Han, Li-Jun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 5
• Pages of publication: m533
• a: 7.3384 ± 0.0007 Å
• b: 24.582 ± 0.002 Å
• c: 8.8559 ± 0.0008 Å
• α: 90°
• β: 111.158 ± 0.001°
• γ: 90°
• Cell volume: 1489.8 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0398
• Residual factor for significantly intense reflections: 0.0318
• Weighted residual factors for significantly intense reflections: 0.0802
• Weighted residual factors for all reflections included in the refinement: 0.084
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes