Information card for entry 2224981

Structure parameters

• Chemical name: Bis(2,2'-bipyridyl)(dichloroacetato)copper(II) dichloroacetate dihydrate
• Formula: C24 H22 Cl4 Cu N4 O6
• Calculated formula: C24 H22 Cl4 Cu N4 O6
• SMILES: [Cu]12(OC(=O)C(Cl)Cl)([n]3ccccc3c3[n]1cccc3)[n]1ccccc1c1[n]2cccc1.ClC(Cl)C(=O)[O-].O.O
• Title of publication: Bis(2,2'-bipyridyl)(dichloroacetato)copper(II) dichloroacetate dihydrate
• Authors of publication: Li, Yu-Feng; Wang, Lin-Tong; Jian, Fang-Fang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 2
• Pages of publication: m141
• a: 9.971 ± 0.0007 Å
• b: 11.7307 ± 0.0009 Å
• c: 12.4736 ± 0.0009 Å
• α: 105.407 ± 0.001°
• β: 101.499 ± 0.001°
• γ: 95.513 ± 0.001°
• Cell volume: 1361.07 ± 0.17 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0397
• Residual factor for significantly intense reflections: 0.0343
• Weighted residual factors for significantly intense reflections: 0.0935
• Weighted residual factors for all reflections included in the refinement: 0.0965
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes