Information card for entry 1564690

Structure parameters

• Chemical name: Ethyl 2-[(<i>E</i>)-({2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]\ benzylidene}amino)oxy]acetate
• Formula: C22 H25 N O6
• Calculated formula: C22 H25 N O6
• SMILES: c1(cc(c(c(c1)OC)/C=N/OCC(=O)OCC)/C=C/c1ccc(cc1)OC)OC
• Title of publication: Ethyl 2-[(<i>E</i>)-({2,4-dimethoxy-6-[2-(4-methoxyphenyl)ethenyl]benzylidene}amino)oxy]acetate
• Authors of publication: Sung, Jiha
• Journal of publication: IUCrData
• Year of publication: 2021
• Journal volume: 6
• Journal issue: 9
• Pages of publication: x210950
• a: 11.3656 ± 0.0009 Å
• b: 7.0636 ± 0.0005 Å
• c: 26.035 ± 0.002 Å
• α: 90°
• β: 100.148 ± 0.003°
• γ: 90°
• Cell volume: 2057.4 ± 0.3 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0545
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1245
• Weighted residual factors for all reflections included in the refinement: 0.133
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes