Information card for entry 2223669

Structure parameters

• Chemical name: 1-Formyl-<i>r</i>-2,<i>c</i>-6-bis(4-methoxyphenyl)- <i>t</i>-3,<i>t</i>-5-dimethylpiperidin-4-one
• Formula: C22 H25 N O4
• Calculated formula: C22 H25 N O4
• SMILES: O=CN1[C@H](c2ccc(cc2)OC)[C@@H](C)C(=O)[C@H]([C@@H]1c1ccc(cc1)OC)C
• Title of publication: 1-Formyl-<i>r</i>-2,<i>c</i>-6-bis(4-methoxyphenyl)-<i>t</i>-3,<i>t</i>-5-dimethylpiperidin-4-one
• Authors of publication: Kavitha, T.; Sakthivel, P.; Ponnuswamy, S.; Ilango, S. S.; Ponnuswamy, M. N.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 11
• Pages of publication: o2818
• a: 11.0954 ± 0.0004 Å
• b: 14.5407 ± 0.0003 Å
• c: 12.705 ± 0.0004 Å
• α: 90°
• β: 110.977 ± 0.001°
• γ: 90°
• Cell volume: 1913.91 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• 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: 0.0766
• Residual factor for significantly intense reflections: 0.0484
• Weighted residual factors for significantly intense reflections: 0.1237
• Weighted residual factors for all reflections included in the refinement: 0.1396
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes