Information card for entry 2243000

Structure parameters

• Chemical name: <i>N</i>'-[1-(4-Methoxyphenyl)benzylidene]-2-(thiophen-3-yl)acetohydrazide
• Formula: C14 H14 N2 O2 S
• Calculated formula: C14 H14 N2 O2 S
• SMILES: s1cc(cc1)CC(=O)N/N=C/c1ccc(cc1)OC
• Title of publication: Crystal structure of two <i>N</i>'-(1-phenylbenzylidene)-2-(thiophen-3-yl)acetohydrazides
• Authors of publication: Vu Quoc, Trung; Nguyen Ngoc, Linh; Tran Thi Thuy, Duong; Vu Quoc, Manh; Vuong Nguyen, Thien; Oanh Doan Thi, Yen; Van Meervelt, Luc
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2019
• Journal volume: 75
• Journal issue: 8
• Pages of publication: 1090 - 1095
• a: 6.5185 ± 0.0002 Å
• b: 9.7447 ± 0.0005 Å
• c: 10.9291 ± 0.0006 Å
• α: 78.327 ± 0.004°
• β: 83.07 ± 0.004°
• γ: 87.013 ± 0.004°
• Cell volume: 674.63 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0624
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.1367
• Weighted residual factors for all reflections included in the refinement: 0.1453
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes