Information card for entry 2012301

Structure parameters

• Chemical name: trans-dibromobis(5-tert-butylpyrazole-N^2^)copper(II)
• Formula: C14 H24 Br2 Cu N4
• Calculated formula: C14 H23.9999 Br2 Cu N4
• Title of publication: Two complexes of CuBr~2~ with 5-<i>tert</i>-butylpyrazole
• Authors of publication: Liu, Xiaoming; Kilner, Colin A.; Thornton-Pett, Mark; Halcrow, Malcolm A.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2001
• Journal volume: 57
• Journal issue: 11
• Pages of publication: 1253 - 1255
• a: 17.4947 ± 0.0002 Å
• b: 9.873 ± 0.0001 Å
• c: 11.1165 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1920.1 ± 0.03 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 29
• Hermann-Mauguin space group symbol: P c a 21
• Hall space group symbol: P 2c -2ac
• Residual factor for all reflections: 0.0245
• Residual factor for significantly intense reflections: 0.0235
• Weighted residual factors for all reflections included in the refinement: 0.0597
• Goodness-of-fit parameter for all reflections included in the refinement: 1.058
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes