Information card for entry 2208555

Structure parameters

• Chemical name: Dibromo{2-[3-(methylamino)propyliminomethyl]phenolato}zinc(II)
• Formula: C11 H16 Br2 N2 O Zn
• Calculated formula: C11 H16 Br2 N2 O Zn
• SMILES: [Zn]1(Br)(Br)Oc2c(cccc2)C=[N]1CCC[NH2+]C
• Title of publication: Dibromo{2-[3-(methylamino)propyliminomethyl]phenolato}zinc(II)
• Authors of publication: Xiao-Yang Qiu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 4
• Pages of publication: m717 - m718
• a: 11.757 ± 0.002 Å
• b: 14.363 ± 0.002 Å
• c: 17.535 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2961.1 ± 0.7 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0968
• Residual factor for significantly intense reflections: 0.0459
• Weighted residual factors for significantly intense reflections: 0.0976
• Weighted residual factors for all reflections included in the refinement: 0.119
• Goodness-of-fit parameter for all reflections included in the refinement: 1.012
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes