Information card for entry 2229224

Structure parameters

• Common name: 1,2-Bis(2-methoxy-6-formylphenoxy)ethane
• Chemical name: 3,3'-Dimethoxy-2,2'-(ethane-1,2-diyldioxy)dibenzaldehyde
• Formula: C18 H18 O6
• Calculated formula: C18 H18 O6
• SMILES: COc1cccc(c1OCCOc1c(cccc1C=O)OC)C=O
• Title of publication: 1,2-Bis(2-methoxy-6-formylphenoxy)ethane
• Authors of publication: Li, Hongqi; Cai, Li; Chen, Dongling; Li, Jinxing; Chen, Yijun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 2
• Pages of publication: o306
• a: 4.161 ± 0.003 Å
• b: 30.155 ± 0.018 Å
• c: 12.934 ± 0.008 Å
• α: 90°
• β: 96.817 ± 0.007°
• γ: 90°
• Cell volume: 1611.4 ± 1.8 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 3
• 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: 0.1274
• Residual factor for significantly intense reflections: 0.0598
• Weighted residual factors for significantly intense reflections: 0.1164
• Weighted residual factors for all reflections included in the refinement: 0.1406
• Goodness-of-fit parameter for all reflections included in the refinement: 0.996
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No