Information card for entry 2220368

Structure parameters

• Chemical name: (<i>E</i>)-N'-(5-Bromo-2-hydroxybenzylidene)-<i>p</i>-toluenesulfonohydrazide
• Formula: C14 H13 Br N2 O3 S
• Calculated formula: C14 H13 Br N2 O3 S
• SMILES: Brc1ccc(O)c(c1)/C=N/NS(=O)(=O)c1ccc(cc1)C
• Title of publication: (<i>E</i>)-<i>N</i>'-(5-Bromo-2-hydroxybenzylidene)-<i>p</i>-toluenesulfonohydrazide
• Authors of publication: Kia, Reza; Fun, Hoong-Kun; Kargar, Hadi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: o2341
• a: 15.889 ± 0.0003 Å
• b: 9.8502 ± 0.0002 Å
• c: 9.8702 ± 0.0002 Å
• α: 90°
• β: 105.475 ± 0.001°
• γ: 90°
• Cell volume: 1488.78 ± 0.05 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 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: 0.037
• Residual factor for significantly intense reflections: 0.028
• Weighted residual factors for significantly intense reflections: 0.071
• Weighted residual factors for all reflections included in the refinement: 0.079
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes