Information card for entry 2234318

Structure parameters

• Chemical name: (<i>E</i>)-2-(2,3-Dimethylanilino)-<i>N</i>'-[2-methyl-5-(prop-1-en- 2-yl)cyclohex-2-enylidene]benzohydrazide
• Formula: C25 H29 N3 O
• Calculated formula: C25 H29 N3 O
• SMILES: O=C(N/N=C1/C(=CC[C@H](C1)C(C)=C)C)c1ccccc1Nc1cccc(c1C)C
• Title of publication: (<i>E</i>)-2-(2,3-Dimethylanilino)-<i>N</i>'-[2-methyl-5-(prop-1-en-2-yl)cyclohex-2-enylidene]benzohydrazide
• Authors of publication: Bhat, Mashooq A.; Abdel-Aziz, Hatem A.; Ghabbour, Hazem A.; Hemamalini, Madhukar; Fun, Hoong-Kun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 4
• Pages of publication: o1135
• a: 9.0296 ± 0.0004 Å
• b: 18.0457 ± 0.0007 Å
• c: 27.4755 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4477 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0848
• Residual factor for significantly intense reflections: 0.0586
• Weighted residual factors for significantly intense reflections: 0.1514
• Weighted residual factors for all reflections included in the refinement: 0.1673
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes