Information card for entry 2204143

Structure parameters

• Chemical name: Bromotetrakis(1H-imidazole-κN^3^)copper(II) bromide
• Formula: C12 H16 Br2 Cu N8
• Calculated formula: C12 H16 Br2 Cu N8
• SMILES: Br[Cu]([n]1cc[nH]c1)([n]1cc[nH]c1)([n]1cc[nH]c1)[n]1cc[nH]c1.[Br-]
• Title of publication: Bromotetrakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II) bromide
• Authors of publication: Hossaini Sadr, Moayad; Zare, Davood; Lewis, William; Wikaira, Jan; Robinson, Ward T.; Ng, Seik Weng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 9
• Pages of publication: m1324 - m1326
• a: 8.9625 ± 0.0003 Å
• b: 13.214 ± 0.0005 Å
• c: 13.9889 ± 0.0005 Å
• α: 90°
• β: 90.052 ± 0.001°
• γ: 90°
• Cell volume: 1656.71 ± 0.1 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 5
• 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: 0.0577
• Residual factor for significantly intense reflections: 0.0534
• Weighted residual factors for significantly intense reflections: 0.1618
• Weighted residual factors for all reflections included in the refinement: 0.1677
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No