Information card for entry 8102165

Structure parameters

• Chemical name: dichloro[N-ethyl-N'-(1-pyridin-2-yl-methylidene)ethane-1,2-diamino)zinc(II)
• Formula: C10 H15 Cl2 N3 Zn
• Calculated formula: C10 H15 Cl2 N3 Zn
• SMILES: [Zn]12(Cl)(Cl)[n]3ccccc3C=[N]1CC[NH]2CC
• Title of publication: Crystal structure of dichloro(N-ethyl-N'-(1-pyridin-2-yl-methylidene) ethane-1,2-diamino)zinc(II), Zn(C~10~H~15~N~3~)Cl~2~
• Authors of publication: Wang, Ying-Zhen; Li, Lan-Lan; Su, Yong-Qing; Li, Cong
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2007
• Journal volume: 222
• Journal issue: 3
• Pages of publication: 329 - 330
• a: 8.304 ± 0.001 Å
• b: 8.465 ± 0.001 Å
• c: 10.852 ± 0.002 Å
• α: 111.33 ± 0.01°
• β: 95.85 ± 0.02°
• γ: 104.7 ± 0.02°
• Cell volume: 671.2 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0511
• Residual factor for significantly intense reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.0793
• Weighted residual factors for all reflections included in the refinement: 0.0861
• Goodness-of-fit parameter for all reflections included in the refinement: 0.973
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No