Information card for entry 2226443

Structure parameters

• Chemical name: 5-Methoxy-1-(3,4,5-trimethoxyphenyl)-1<i>H</i>-indole
• Formula: C18 H19 N O4
• Calculated formula: C18 H19 N O4
• SMILES: O(c1cc(n2c3ccc(OC)cc3cc2)cc(OC)c1OC)C
• Title of publication: 5-Methoxy-1-(3,4,5-trimethoxyphenyl)-1<i>H</i>-indole
• Authors of publication: Monroe, Thomas Blake; Rimland, Casey; Moazami, Yasamin; Jones, Daniel S.; Ogle, Craig A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: o1678
• a: 19.0036 ± 0.0016 Å
• b: 7.3179 ± 0.0014 Å
• c: 23.672 ± 0.004 Å
• α: 90°
• β: 96.802 ± 0.01°
• γ: 90°
• Cell volume: 3268.8 ± 0.9 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for all reflections included in the refinement: 0.1098
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes