Information card for entry 2239604

Structure parameters

• Chemical name: (<i>E</i>)-1,3-Dimethyl-2,6-diphenylpiperidin-4-one <i>O</i>-(phenoxycarbonyl)oxime
• Formula: C26 H26 N2 O3
• Calculated formula: C26 H26 N2 O3
• SMILES: O=C(Oc1ccccc1)O/N=C1\C[C@H](c2ccccc2)N([C@@H]([C@H]1C)c1ccccc1)C.O=C(Oc1ccccc1)O/N=C1\C[C@@H](c2ccccc2)N([C@H]([C@@H]1C)c1ccccc1)C
• Title of publication: (<i>E</i>)-1,3-Dimethyl-2,6-diphenylpiperidin-4-one <i>O</i>-(phenoxycarbonyl)oxime
• Authors of publication: Raghuvarman, B.; Sivakumar, R.; Gokula Krishnan, K.; Thanikachalam, V.; Aravindhan, S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 6
• Pages of publication: o713
• a: 16.2004 ± 0.0012 Å
• b: 11.9587 ± 0.001 Å
• c: 11.3601 ± 0.0007 Å
• α: 90°
• β: 102.547 ± 0.002°
• γ: 90°
• Cell volume: 2148.3 ± 0.3 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.099
• Residual factor for significantly intense reflections: 0.0526
• Weighted residual factors for significantly intense reflections: 0.1499
• Weighted residual factors for all reflections included in the refinement: 0.1799
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes