Information card for entry 8107115

Structure parameters

• Formula: C19 H17 Cl N4
• Calculated formula: C19 H17 Cl N4
• SMILES: c1(ccc(cc1)/C=N/NC1=C(CN(C1)c1ccc(cc1)C)C#N)Cl
• Title of publication: Crystal structure of (Z)-4-((E)-(4-chlorobenzyli-dene)hydrazono)-1-p-tolylpyrrolidine-3-carbonitrile, C19H17ClN4
• Authors of publication: El-Hiti, Gamal A.; Abdel-Wahab, Bakr F.; Baashen, Mohammed; Hegazy, Amany S.; Kariuki, Benson M.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2016
• Journal volume: 231
• Journal issue: 4
• Pages of publication: 1109 - 1110
• a: 6.9042 ± 0.0005 Å
• b: 7.199 ± 0.0005 Å
• c: 18.2633 ± 0.0013 Å
• α: 86.727 ± 0.006°
• β: 79.214 ± 0.006°
• γ: 69.876 ± 0.007°
• Cell volume: 837.24 ± 0.11 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1062
• Residual factor for significantly intense reflections: 0.0553
• Weighted residual factors for significantly intense reflections: 0.1155
• Weighted residual factors for all reflections included in the refinement: 0.1406
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No