Information card for entry 2239285

Structure parameters

• Chemical name: <i>c</i>-3,<i>t</i>-5-Dimethyl-<i>r</i>-2,<i>c</i>-6-diphenylpiperidine
• Formula: C19 H23 N
• Calculated formula: C19 H23 N
• SMILES: C[C@@H]1C[C@@H](C)[C@@H](N[C@@H]1c1ccccc1)c1ccccc1.C[C@H]1C[C@H](C)[C@H](N[C@H]1c1ccccc1)c1ccccc1
• Title of publication: 3,5-Dimethyl-2,6-diphenylpiperidine
• Authors of publication: Sathya, S.; Prathebha, K.; Usha, G.; Abdul Basheer, S.; Ponnuswamy, S.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2014
• Journal volume: 70
• Journal issue: 4
• Pages of publication: o404
• a: 10.1689 ± 0.0008 Å
• b: 43.141 ± 0.003 Å
• c: 7.2658 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3187.5 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 45
• Hermann-Mauguin space group symbol: I b a 2
• Hall space group symbol: I 2 -2c
• Residual factor for all reflections: 0.0788
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.1722
• Weighted residual factors for all reflections included in the refinement: 0.2156
• Goodness-of-fit parameter for all reflections included in the refinement: 0.776
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes