Information card for entry 2211538

Structure parameters

• Chemical name: Bis(μ-4-methoxypyridine N-oxide-κ^2^O:O)bis[dibromocopper(II)]
• Formula: C12 H14 Br4 Cu2 N2 O4
• Calculated formula: C12 H14 Br4 Cu2 N2 O4
• SMILES: c1cc(ccn1=[O]1[Cu](Br)(Br)[O](=n2ccc(cc2)OC)[Cu]1(Br)Br)OC
• Title of publication: Bis(μ-4-methoxypyridine <i>N</i>-oxide-κ^2^<i>O</i>:<i>O</i>)bis[dibromocopper(II)]
• Authors of publication: Zhang, Shi-Guo; Li, Wei-Nan; Shi, Jing-Min
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 12
• Pages of publication: m3181 - m3182
• a: 12.102 ± 0.003 Å
• b: 10.054 ± 0.003 Å
• c: 7.767 ± 0.002 Å
• α: 90°
• β: 90.962 ± 0.004°
• γ: 90°
• Cell volume: 944.9 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0814
• Residual factor for significantly intense reflections: 0.0676
• Weighted residual factors for significantly intense reflections: 0.1462
• Weighted residual factors for all reflections included in the refinement: 0.1527
• Goodness-of-fit parameter for all reflections included in the refinement: 1.131
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes