Information card for entry 2223276

Structure parameters

• Chemical name: Poly[(μ~3~-5-bromonicotinato)(5-bromonicotinato)copper(II)]
• Formula: C12 H6 Br2 Cu N2 O4
• Calculated formula: C12 H6 Br2 Cu N2 O4
• Title of publication: Poly[(μ~3~-5-bromonicotinato)(5-bromonicotinato)copper(II)]
• Authors of publication: Yang, Jun; Chen, Hong-Ji
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 10
• Pages of publication: m1262 - m1263
• a: 21.542 ± 0.004 Å
• b: 11.746 ± 0.002 Å
• c: 12.271 ± 0.002 Å
• α: 90°
• β: 104.31 ± 0.03°
• γ: 90°
• Cell volume: 3008.6 ± 1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0549
• Residual factor for significantly intense reflections: 0.034
• Weighted residual factors for significantly intense reflections: 0.0762
• Weighted residual factors for all reflections included in the refinement: 0.0853
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes