Information card for entry 2231489

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>'-(5-Bromo-2-methoxybenzylidene)-2-chlorobenzohydrazide
• Formula: C15 H12 Br Cl N2 O2
• Calculated formula: C15 H12 Br Cl N2 O2
• SMILES: Brc1ccc(OC)c(c1)/C=N/NC(=O)c1c(Cl)cccc1
• Title of publication: (<i>E</i>)-<i>N</i>'-(5-Bromo-2-methoxybenzylidene)-2-chlorobenzohydrazide
• Authors of publication: Li, Xiao-Yan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 9
• Pages of publication: o2511
• a: 11.312 ± 0.002 Å
• b: 7.374 ± 0.002 Å
• c: 17.979 ± 0.003 Å
• α: 90°
• β: 91.972 ± 0.003°
• γ: 90°
• Cell volume: 1498.8 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• 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: 0.0554
• Residual factor for significantly intense reflections: 0.0361
• Weighted residual factors for significantly intense reflections: 0.0848
• Weighted residual factors for all reflections included in the refinement: 0.0939
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes