Information card for entry 2236898

Structure parameters

• Chemical name: Bromidotetrakis(2-ethyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II) bromide
• Formula: C20 H32 Br2 Cu N8
• Calculated formula: C20 H32 Br2 Cu N8
• SMILES: [Cu](Br)([n]1cc[nH]c1CC)([n]1cc[nH]c1CC)([n]1cc[nH]c1CC)[n]1cc[n]c1CC.[Br-]
• Title of publication: Bromidotetrakis(2-ethyl-1<i>H</i>-imidazole-κ<i>N</i>^3^)copper(II) bromide
• Authors of publication: Godlewska, Sylwia; Kelm, Harald; Krüger, Hans-Jörg; Dołega, Anna
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 12
• Pages of publication: m1529
• a: 10.1771 ± 0.0002 Å
• b: 19.923 ± 0.0003 Å
• c: 12.5723 ± 0.0002 Å
• α: 90°
• β: 90.386 ± 0.002°
• γ: 90°
• Cell volume: 2549.08 ± 0.08 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0266
• Residual factor for significantly intense reflections: 0.0238
• Weighted residual factors for significantly intense reflections: 0.0592
• Weighted residual factors for all reflections included in the refinement: 0.06
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes