Information card for entry 2220315

Structure parameters

• Chemical name: (<i>E</i>)-<i>N</i>'-(5-Bromo-2-hydroxybenzylidene)-3,4,5- trimethoxybenzohydrazide
• Formula: C17 H17 Br N2 O5
• Calculated formula: C17 H17 Br N2 O5
• SMILES: Brc1cc(c(O)cc1)/C=N/NC(=O)c1cc(OC)c(OC)c(OC)c1
• Title of publication: (<i>E</i>)-<i>N</i>'-(5-Bromo-2-hydroxybenzylidene)-3,4,5-trimethoxybenzohydrazide
• Authors of publication: Zhao, Zhen-dong; Wang, Yu-min; Chen, Yu-xiang; Bi, Liang-wu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: o2408
• a: 11.4157 ± 0.0019 Å
• b: 16.279 ± 0.003 Å
• c: 9.3738 ± 0.0016 Å
• α: 90°
• β: 100.21 ± 0.003°
• γ: 90°
• Cell volume: 1714.4 ± 0.5 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.0669
• Residual factor for significantly intense reflections: 0.0369
• Weighted residual factors for significantly intense reflections: 0.0845
• Weighted residual factors for all reflections included in the refinement: 0.0969
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes