Information card for entry 1542601

Structure parameters

• Chemical name: (<i>E</i>)-4-Chloro-<i>N</i>'-(2,4,5-trifluorobenzylidene)benzohydrazide
• Formula: C14 H8 Cl F3 N2 O
• Calculated formula: C14 H8 Cl F3 N2 O
• SMILES: Clc1ccc(cc1)C(=O)N/N=C/c1c(F)cc(F)c(F)c1
• Title of publication: (<i>E</i>)-4-Chloro-<i>N</i>'-(2,4,5-trifluorobenzylidene)benzohydrazide
• Authors of publication: Maheswari, R.; Manjula, J.; Gunasekaran, B.
• Journal of publication: IUCrData
• Year of publication: 2016
• Journal volume: 1
• Journal issue: 3
• Pages of publication: x160304
• a: 6.4998 ± 0.0002 Å
• b: 7.4286 ± 0.0002 Å
• c: 14.8289 ± 0.0004 Å
• α: 84.859 ± 0.002°
• β: 86.707 ± 0.002°
• γ: 83.313 ± 0.002°
• Cell volume: 707.47 ± 0.03 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0579
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for significantly intense reflections: 0.1111
• Weighted residual factors for all reflections included in the refinement: 0.1203
• Goodness-of-fit parameter for all reflections included in the refinement: 0.994
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes