Information card for entry 2203621

Structure parameters

• Chemical name: (Z)-2,3-bis(3,4-dimethoxyphenyl)-2-propen-1-ol
• Formula: C19 H22 O5
• Calculated formula: C19 H22 O5
• SMILES: c1(cc(c(cc1)OC)OC)/C=C(/c1cc(c(cc1)OC)OC)CO
• Title of publication: (<i>Z</i>)-2,3-Bis(3,4-dimethoxyphenyl)-2-propen-1-ol
• Authors of publication: Stomberg, Rolf; Albinsson, Bo; Langer, Vratislav; Li, Shiming; Lundquist, Knut
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 5
• Pages of publication: o804 - o806
• a: 10.097 ± 0.002 Å
• b: 10.358 ± 0.002 Å
• c: 8.665 ± 0.002 Å
• α: 103.08 ± 0.02°
• β: 101.93 ± 0.02°
• γ: 78.1 ± 0.02°
• Cell volume: 851.5 ± 0.3 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0989
• Residual factor for significantly intense reflections: 0.0344
• Weighted residual factors for significantly intense reflections: 0.0839
• Weighted residual factors for all reflections included in the refinement: 0.1069
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes