Information card for entry 2235850

Structure parameters

• Chemical name: (<i>E</i>)-2-(2,3-Dimethylanilino)-<i>N</i>'-(thiophen-2- ylmethylidene)benzohydrazide
• Formula: C20 H19 N3 O S
• Calculated formula: C20 H19 N3 O S
• SMILES: s1c(/C=N/NC(=O)c2c(Nc3cccc(c3C)C)cccc2)ccc1
• Title of publication: (<i>E</i>)-2-(2,3-Dimethylanilino)-<i>N</i>'-(thiophen-2-ylmethylidene)benzohydrazide
• Authors of publication: Fun, Hoong-Kun; Chia, Tze Shyang; Bhat, Mashooq A.; Al-Omar, Mohamed A.; Abdel-Aziz, Hatem A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 8
• Pages of publication: o2524 - o2525
• a: 14.0922 ± 0.0014 Å
• b: 15.9682 ± 0.0015 Å
• c: 8.1338 ± 0.0008 Å
• α: 90°
• β: 105.344 ± 0.002°
• γ: 90°
• Cell volume: 1765.1 ± 0.3 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 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: 0.0911
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.1101
• Weighted residual factors for all reflections included in the refinement: 0.128
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes