Information card for entry 2206968

Structure parameters

• Chemical name: Bis[2-(1H-benzimidazol-2-yl)phenolato]copper(II) dimethylformamide disolvate
• Formula: C32 H32 Cu N6 O4
• Calculated formula: C32 H32 Cu N6 O4
• SMILES: c12ccccc1[nH]c1c3ccccc3O[Cu]3([n]21)[n]1c2ccccc2[nH]c1c1ccccc1O3.N(C=O)(C)C.N(C=O)(C)C
• Title of publication: Bis[2-(1<i>H</i>-benzimidazol-2-yl)phenolato]copper(II) dimethylformamide disolvate
• Authors of publication: Xi, Yun; Li, Jun; Zhang, Fengxing
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 10
• Pages of publication: m1953 - m1954
• a: 16.1964 ± 0.0009 Å
• b: 8.0465 ± 0.0004 Å
• c: 22.5076 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2933.3 ± 0.3 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0805
• Residual factor for significantly intense reflections: 0.0425
• Weighted residual factors for significantly intense reflections: 0.1012
• Weighted residual factors for all reflections included in the refinement: 0.1153
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes