Information card for entry 2219871

Structure parameters

• Chemical name: (E)-Ethyl N'-(3,4,5-trimethoxybenzylidene)hydrazinecarboxylate
• Formula: C13 H18 N2 O5
• Calculated formula: C13 H18 N2 O5
• SMILES: c1c(cc(c(c1OC)OC)OC)/C=N/NC(=O)OCC
• Title of publication: (<i>E</i>)-Ethyl <i>N</i>'-(3,4,5-trimethoxybenzylidene)hydrazinecarboxylate
• Authors of publication: Lv, Lu-Ping; Ding, Xiao-Ming; Yu, Wen-Bo; Li, Wei-Wei; Hu, Xian-Chao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 11
• Pages of publication: o2127
• a: 22.037 ± 0.002 Å
• b: 4.8782 ± 0.0005 Å
• c: 14.0212 ± 0.0015 Å
• α: 90°
• β: 108.239 ± 0.004°
• γ: 90°
• Cell volume: 1431.6 ± 0.3 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 4
• 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: 0.0428
• Residual factor for significantly intense reflections: 0.0347
• Weighted residual factors for significantly intense reflections: 0.0867
• Weighted residual factors for all reflections included in the refinement: 0.0937
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes