Information card for entry 2217059

Structure parameters

• Chemical name: 1-(2-Hydroxy-5-methoxyphenyl)ethan-1-one N-[(E)-1-(2-hydroxy-5-methoxyphenyl)ethylidene]hydrazone
• Formula: C18 H20 N2 O4
• Calculated formula: C18 H20 N2 O4
• SMILES: COc1ccc(c(c1)/C(=N/N=C(/c1cc(OC)ccc1O)C)C)O
• Title of publication: 1-(2-Hydroxy-5-methoxyphenyl)ethan-1-one <i>N</i>-[(<i>E</i>)-1-(2-hydroxy-5-methoxyphenyl)ethylidene]hydrazone
• Authors of publication: Zhang, Jin-Hua; Dong, Wen-Liang; Ge, Yan-Qing; Zhao, Bao-Xiang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 1
• Pages of publication: o166 - o166
• a: 8.5545 ± 0.0007 Å
• b: 6.4614 ± 0.0004 Å
• c: 14.3548 ± 0.001 Å
• α: 90°
• β: 91.243 ± 0.005°
• γ: 90°
• Cell volume: 793.26 ± 0.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.0701
• Residual factor for significantly intense reflections: 0.0473
• Weighted residual factors for significantly intense reflections: 0.1474
• Weighted residual factors for all reflections included in the refinement: 0.1779
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes