Information card for entry 2230573

Structure parameters

• Chemical name: Bis[4-bromo-2-(ethyliminomethyl)phenolato-κ^2^<i>N</i>,<i>O</i>]nickel(II)
• Formula: C18 H18 Br2 N2 Ni O2
• Calculated formula: C18 H18 Br2 N2 Ni O2
• SMILES: c12c(cc(cc1)Br)C=[N](CC)[Ni]1(O2)[N](=Cc2c(ccc(c2)Br)O1)CC
• Title of publication: Bis[4-bromo-2-(ethyliminomethyl)phenolato-κ^2^<i>N</i>,<i>O</i>]nickel(II)
• Authors of publication: Chen, Fu Li; Zhang, Shu Hua; Guo, Jing Jing; Zhang, Yi Dong; Feng, Chao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 7
• Pages of publication: m858
• a: 13.456 ± 0.006 Å
• b: 4.803 ± 0.002 Å
• c: 14.743 ± 0.006 Å
• α: 90°
• β: 102.157 ± 0.008°
• γ: 90°
• Cell volume: 931.5 ± 0.7 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0857
• Residual factor for significantly intense reflections: 0.0567
• Weighted residual factors for significantly intense reflections: 0.1343
• Weighted residual factors for all reflections included in the refinement: 0.1416
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes