Information card for entry 2224559

Structure parameters

• Chemical name: 1,1'-(<i>p</i>-Phenylenedimethylene)dipiperidin-4-one
• Formula: C18 H24 N2 O2
• Calculated formula: C18 H24 N2 O2
• SMILES: O=C1CCN(CC1)Cc1ccc(cc1)CN1CCC(=O)CC1
• Title of publication: 1,1'-(<i>p</i>-Phenylenedimethylene)dipiperidin-4-one
• Authors of publication: Vijayakumar, V.; Rajesh, K.; Suresh, J.; Narasimhamurthy, T.; Lakshman, P. L. Nilantha
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 1
• Pages of publication: o170
• a: 6.2701 ± 0.0005 Å
• b: 8.099 ± 0.0006 Å
• c: 15.8978 ± 0.0013 Å
• α: 90°
• β: 98.275 ± 0.002°
• γ: 90°
• Cell volume: 798.91 ± 0.11 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: 0.0556
• Residual factor for significantly intense reflections: 0.0434
• Weighted residual factors for significantly intense reflections: 0.1148
• Weighted residual factors for all reflections included in the refinement: 0.1232
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes