Information card for entry 2231870

Structure parameters

• Chemical name: 2-{[2-(2-Hydroxy-3-methoxybenzylidene)hydrazin-1-ylidene]methyl}-6-methoxyphenol
• Formula: C16 H16 N2 O4
• Calculated formula: C16 H16 N2 O4
• SMILES: Oc1c(C=NN=Cc2c(O)c(OC)ccc2)cccc1OC
• Title of publication: 2-{[2-(2-Hydroxy-3-methoxybenzylidene)hydrazin-1-ylidene]methyl}-6-methoxyphenol
• Authors of publication: Lu, Rong; Wang, Wenxia; Lü, Xingqiang; Zhao, Shunsheng
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 10
• Pages of publication: o2702
• a: 6.3095 ± 0.0014 Å
• b: 17.405 ± 0.004 Å
• c: 13.606 ± 0.003 Å
• α: 90°
• β: 95.59 ± 0.004°
• γ: 90°
• Cell volume: 1487.1 ± 0.6 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: 0.1454
• Residual factor for significantly intense reflections: 0.0606
• Weighted residual factors for significantly intense reflections: 0.1457
• Weighted residual factors for all reflections included in the refinement: 0.186
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes