Information card for entry 2204522

Structure parameters

• Chemical name: Diaquabis(4-chlorobenzoato-κO)bis(1H-imidazole-κN^3^)cobalt(II)
• Formula: C20 H20 Cl2 Co N4 O6
• Calculated formula: C20 H20 Cl2 Co N4 O6
• SMILES: [Co](OC(=O)c1ccc(Cl)cc1)(OC(=O)c1ccc(Cl)cc1)([OH2])([OH2])([n]1c[nH]cc1)[n]1c[nH]cc1
• Title of publication: Diaquabis(4-chlorobenzoato-κ<i>O</i>)bis(1<i>H</i>-imidazole-κ<i>N</i>^3^)cobalt(II)
• Authors of publication: Tu-Gen Xu; Duan-Jun Xu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 11
• Pages of publication: m1669 - m1671
• a: 13.2773 ± 0.0011 Å
• b: 5.4948 ± 0.0006 Å
• c: 16.0402 ± 0.0014 Å
• α: 90°
• β: 95.7432 ± 0.0018°
• γ: 90°
• Cell volume: 1164.36 ± 0.19 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• 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: 0.035
• Residual factor for significantly intense reflections: 0.03
• Weighted residual factors for significantly intense reflections: 0.079
• Weighted residual factors for all reflections included in the refinement: 0.081
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes