Information card for entry 2205363

Structure parameters

• Formula: C19 H18 O3
• Calculated formula: C19 H18 O3
• SMILES: O(c1c(OC)c(OC)cc(c1)c1c2c(ccc1)cccc2)C
• Title of publication: 1-(3,4,5-Trimethoxyphenyl)naphthalene
• Authors of publication: Binita Suthar; Anthony Fowler; Daniel S. Jones; Craig A. Ogle
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 3
• Pages of publication: o607 - o608
• a: 6.746 ± 0.001 Å
• b: 12.605 ± 0.004 Å
• c: 18.32 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1557.8 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.0375
• Weighted residual factors for all reflections included in the refinement: 0.0978
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes