Information card for entry 2205774

Structure parameters

• Chemical name: trans-Dibromotetra(3-tert-butylpyrazole-κN)nickel(II)
• Formula: C28 H48 Br2 N8 Ni
• Calculated formula: C28 H48 Br2 N8 Ni
• Title of publication: <i>trans</i>-Dibromotetra(3-<i>tert</i>-butylpyrazole-κ<i>N</i>)nickel(II)
• Authors of publication: Annie Michaud; Frédéric-Georges Fontaine; Davit Zargarian
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 5
• Pages of publication: m846 - m848
• a: 17.822 ± 0.004 Å
• b: 9.536 ± 0.002 Å
• c: 21.256 ± 0.005 Å
• α: 90°
• β: 97.445 ± 0.017°
• γ: 90°
• Cell volume: 3582 ± 1.4 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 2 K
• Number of distinct elements: 5
• 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: 0.0465
• Residual factor for significantly intense reflections: 0.045
• Weighted residual factors for significantly intense reflections: 0.124
• Weighted residual factors for all reflections included in the refinement: 0.1254
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes