Information card for entry 2226147

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>'-(4-Methoxybenzylidene)thiophene-2-carbohydrazide
• Formula: C13 H12 N2 O2 S
• Calculated formula: C13 H12 N2 O2 S
• SMILES: s1c(C(=O)N/N=C/c2ccc(OC)cc2)ccc1
• Title of publication: (<i>E</i>)-<i>N</i>'-(4-Methoxybenzylidene)thiophene-2-carbohydrazide
• Authors of publication: Li, Yu-Feng; Jian, Fang-Fang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 6
• Pages of publication: o1400
• a: 16.106 ± 0.003 Å
• b: 5.3292 ± 0.0011 Å
• c: 14.812 ± 0.003 Å
• α: 90°
• β: 104.91 ± 0.03°
• γ: 90°
• Cell volume: 1228.5 ± 0.5 ų
• Cell temperature: 293 ± 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: 0.0613
• Residual factor for significantly intense reflections: 0.0557
• Weighted residual factors for significantly intense reflections: 0.171
• Weighted residual factors for all reflections included in the refinement: 0.177
• Goodness-of-fit parameter for all reflections included in the refinement: 1.003
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes