Information card for entry 2232234

Structure parameters

• Chemical name: Bis[μ-2-(pyridin-2-yl)ethanolato]bis[bromidocopper(II)]
• Formula: C14 H16 Br2 Cu2 N2 O2
• Calculated formula: C14 H16 Br2 Cu2 N2 O2
• SMILES: Br[Cu]12[n]3ccccc3CC[O]1[Cu]1([n]3ccccc3CC[O]21)Br
• Title of publication: Bis[μ-2-(pyridin-2-yl)ethanolato]bis[bromidocopper(II)]
• Authors of publication: Shaikh, M. Mobin; Mathur, Saloni; Uddin, Md. Jamal
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 11
• Pages of publication: m1612
• a: 4.2066 ± 0.0002 Å
• b: 8.4338 ± 0.0003 Å
• c: 11.5113 ± 0.0006 Å
• α: 91.122 ± 0.004°
• β: 90.195 ± 0.003°
• γ: 97.033 ± 0.001°
• Cell volume: 405.24 ± 0.03 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0331
• Residual factor for significantly intense reflections: 0.0314
• Weighted residual factors for significantly intense reflections: 0.0854
• Weighted residual factors for all reflections included in the refinement: 0.0874
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes