Information card for entry 2223512

Structure parameters

• Chemical name: Diiodido[<i>N</i>'-(2-methoxybenzylidene)-<i>N</i>,<i>N</i>- dimethylethane-1,2-diamine]zinc(II)
• Formula: C12 H18 I2 N2 O Zn
• Calculated formula: C12 H18 I2 N2 O Zn
• SMILES: [Zn]1(I)(I)[N](=Cc2c(OC)cccc2)CC[N]1(C)C
• Title of publication: Diiodido[<i>N</i>'-(2-methoxybenzylidene)-<i>N</i>,<i>N</i>-dimethylethane-1,2-diamine]zinc(II)
• Authors of publication: Zhu, Xue-Wen; Yin, Zhi-Gang; Zhang, Chun-Xia; Yang, Xu-Zhao; Li, Gang-Sen
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 10
• Pages of publication: m1228
• a: 13.5215 ± 0.0008 Å
• b: 7.2806 ± 0.0004 Å
• c: 18.4224 ± 0.0011 Å
• α: 90°
• β: 109.25 ± 0.003°
• γ: 90°
• Cell volume: 1712.19 ± 0.17 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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: 0.0344
• Residual factor for significantly intense reflections: 0.0268
• Weighted residual factors for significantly intense reflections: 0.0653
• Weighted residual factors for all reflections included in the refinement: 0.0685
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes