Information card for entry 2208298

Structure parameters

• Chemical name: μ-Oxalato-bis[chlorotripyridinecobalt(II)] pyridine disolvate
• Formula: C42 H40 Cl2 Co2 N8 O4
• Calculated formula: C42 H40 Cl2 Co2 N8 O4
• SMILES: C12C(O[Co]([O]=2)(Cl)([n]2ccccc2)([n]2ccccc2)[n]2ccccc2)=[O][Co](O1)(Cl)([n]1ccccc1)([n]1ccccc1)[n]1ccccc1.c1ncccc1.c1ccccn1
• Title of publication: μ-Oxalato-bis[chlorotripyridinecobalt(II)] pyridine disolvate
• Authors of publication: Bolte, Michael
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 3
• Pages of publication: m597 - m598
• a: 9.5335 ± 0.0019 Å
• b: 10.518 ± 0.002 Å
• c: 21.205 ± 0.004 Å
• α: 90°
• β: 91.78 ± 0.03°
• γ: 90°
• Cell volume: 2125.3 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.089
• Residual factor for significantly intense reflections: 0.0628
• Weighted residual factors for significantly intense reflections: 0.1732
• Weighted residual factors for all reflections included in the refinement: 0.1897
• Goodness-of-fit parameter for all reflections included in the refinement: 0.935
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes