Information card for entry 2000626

Structure parameters

• Formula: C18 H20 O5
• Calculated formula: C18 H20 O5
• SMILES: O1COc2cc(c(OCCO)cc12)C(C)c1ccc(OC)cc1
• Title of publication: Structure of 5-(2-hydroxyethoxy)-6-[1-(4-methoxyphenyl)ethyl]-1,3-benzodioxole
• Authors of publication: Sicheri, F. V.; Derry, W. B.; Gupta, R. S.; Yang, D. S.-C.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 9
• Pages of publication: 1687 - 1689
• a: 16.8 ± 0.002 Å
• b: 20.071 ± 0.002 Å
• c: 9.429 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3179.4 ± 0.6 ų
• Number of distinct elements: 3
• Hermann-Mauguin space group symbol: P b c a
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No