Information card for entry 2224898

Structure parameters

• Chemical name: 4-Chloro-<i>N</i>-[4-(diethylamino)benzylidene]aniline
• Formula: C17 H19 Cl N2
• Calculated formula: C17 H19 Cl N2
• SMILES: CCN(c1ccc(cc1)/C=N/c1ccc(cc1)Cl)CC
• Title of publication: 4-Chloro-<i>N</i>-[4-(diethylamino)benzylidene]aniline
• Authors of publication: Zhang, Fu-Gong
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 2
• Pages of publication: o382
• a: 20.153 ± 0.002 Å
• b: 8.7434 ± 0.0007 Å
• c: 20.1446 ± 0.0019 Å
• α: 90°
• β: 118.444 ± 0.002°
• γ: 90°
• Cell volume: 3121.1 ± 0.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0567
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.1189
• Weighted residual factors for all reflections included in the refinement: 0.1268
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes