Information card for entry 2206388

Structure parameters

• Chemical name: N-(4-Chloro-2-nitrophenyl)-N-methyl-N'-(quinolin-4-ylmethylene)hydrazine
• Formula: C17 H13 Cl N4 O2
• Calculated formula: C17 H13 Cl N4 O2
• SMILES: Clc1ccc(N(\N=C\c2c3ccccc3ncc2)C)c(N(=O)=O)c1
• Title of publication: <i>N</i>-(4-Chloro-2-nitrophenyl)-<i>N</i>-methyl-<i>N</i>'-(quinolin-4-ylmethylene)hydrazine
• Authors of publication: Karadayı, Nevzat; Aydemir, Ercan; Kazak, Canan; Kirpi, Erdoğan; Tuğcu, F. Tülay; Gümüs̨, M. Kemal; Kaban, S̨eniz
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 8
• Pages of publication: o2671 - o2673
• a: 12.5083 ± 0.0015 Å
• b: 6.9995 ± 0.0005 Å
• c: 17.885 ± 0.002 Å
• α: 90°
• β: 96.988 ± 0.01°
• γ: 90°
• Cell volume: 1554.2 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.1332
• Residual factor for significantly intense reflections: 0.0441
• Weighted residual factors for significantly intense reflections: 0.059
• Weighted residual factors for all reflections included in the refinement: 0.067
• Goodness-of-fit parameter for all reflections included in the refinement: 0.937
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes