Information card for entry 2224662

Structure parameters

• Chemical name: 1-Methyl-2,6-<i>cis</i>-distyrylpiperidine
• Formula: C22 H25 N
• Calculated formula: C22 H25 N
• SMILES: CN1[C@H](CCC[C@H]1/C=C/c1ccccc1)/C=C/c1ccccc1
• Title of publication: 1-Methyl-2,6-<i>cis</i>-distyrylpiperidine
• Authors of publication: Zheng, Guangrong; Parkin, Sean; Dwoskin, Linda P.; Crooks, Peter A.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 1
• Pages of publication: o77
• a: 17.3766 ± 0.0002 Å
• b: 18.1774 ± 0.0006 Å
• c: 5.5354 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1748.4 ± 0.2 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 1 K
• Number of distinct elements: 3
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0716
• Residual factor for significantly intense reflections: 0.051
• Weighted residual factors for significantly intense reflections: 0.097
• Weighted residual factors for all reflections included in the refinement: 0.1049
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes