Information card for entry 2206164

Structure parameters

• Chemical name: Diaquadibromobis(1H-imidazole)nickel(II)
• Formula: C6 H12 Br2 N4 Ni O2
• Calculated formula: C6 H12 Br2 N4 Ni O2
• SMILES: [OH2][Ni]([n]1c[nH]cc1)([n]1c[nH]cc1)([OH2])(Br)Br
• Title of publication: Diaquadibromobis(1<i>H</i>-imidazole)nickel(II)
• Authors of publication: Zhang, Hui; Fang, Liang; Yuan, Runzhang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 7
• Pages of publication: m1391 - m1392
• a: 7.8 ± 0.0018 Å
• b: 9.366 ± 0.002 Å
• c: 8.474 ± 0.002 Å
• α: 90°
• β: 96.114 ± 0.004°
• γ: 90°
• Cell volume: 615.5 ± 0.2 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 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: 0.0237
• Residual factor for significantly intense reflections: 0.0203
• Weighted residual factors for significantly intense reflections: 0.0496
• Weighted residual factors for all reflections included in the refinement: 0.051
• Goodness-of-fit parameter for all reflections included in the refinement: 1.054
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes