Information card for entry 2216304

Structure parameters

• Chemical name: N,N'-Bis(2,4-dichlorobenzylidene)ethylenediamine
• Formula: C16 H12 Cl4 N2
• Calculated formula: C16 H12 Cl4 N2
• SMILES: Clc1ccc(c(c1)Cl)/C=N/CC/N=C/c1ccc(cc1Cl)Cl
• Title of publication: <i>N</i>,<i>N</i>'-Bis(2,4-dichlorobenzylidene)ethylenediamine
• Authors of publication: Abbasi, Alireza; Mohammadi Ziarani, Ghodsi; Badiei, Alireza; Khaniani, Yeganeh
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 12
• Pages of publication: o4736 - o4736
• a: 13.572 ± 0.002 Å
• b: 4.4991 ± 0.0007 Å
• c: 14.623 ± 0.002 Å
• α: 90°
• β: 115.52 ± 0.02°
• γ: 90°
• Cell volume: 805.8 ± 0.2 ų
• Cell temperature: 290 ± 2 K
• Ambient diffraction temperature: 290 ± 2 K
• Number of distinct elements: 4
• 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: 0.1334
• Residual factor for significantly intense reflections: 0.0966
• Weighted residual factors for significantly intense reflections: 0.239
• Weighted residual factors for all reflections included in the refinement: 0.2477
• Goodness-of-fit parameter for all reflections included in the refinement: 1.472
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes