Information card for entry 2203191

Structure parameters

• Chemical name: Tetrakis(μ-2-bromobenzoato-κ^2^O,O')bis[(N,N'-dimethylformamide)copper(II)]
• Formula: C34 H30 Br4 Cu2 N2 O10
• Calculated formula: C34 H30 Br4 Cu2 N2 O10
• SMILES: N(C=[O][Cu]1234[O]=C(c5c(cccc5)Br)O[Cu]4([O]=C(c4c(cccc4)Br)O1)(OC(c1c(Br)cccc1)=[O]3)([O]=C(c1c(Br)cccc1)O2)[O]=CN(C)C)(C)C
• Title of publication: Tetrakis(μ-2-bromobenzoato-κ^2^<i>O,O</i>')bis[(<i>N,N</i>'-dimethylformamide)copper(II)], a new binuclear complex containing a metal‒metal bond
• Authors of publication: Yu-Liang Zhang; Su-Wen Chen; Wei-Sheng Liu; Da-Qi Wang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 2
• Pages of publication: m196 - m197
• a: 10.278 ± 0.012 Å
• b: 10.885 ± 0.013 Å
• c: 17.55 ± 0.02 Å
• α: 90°
• β: 92.224 ± 0.017°
• γ: 90°
• Cell volume: 1962 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.1126
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for significantly intense reflections: 0.1066
• Weighted residual factors for all reflections included in the refinement: 0.1228
• Goodness-of-fit parameter for all reflections included in the refinement: 0.855
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No