Information card for entry 2101354

Structure parameters

• Formula: C18 H26 N2
• Calculated formula: C18 H26 N2
• SMILES: CCCCCCC1CCN(CC1)c1ccc(cc1)C#N
• Title of publication: Molecular conformations and crystal packing properties of five 4-alkyl-<i>N</i>-(4-cyanophenyl)piperidines by X-ray diffraction: a surprising dependence upon alkyl chain length
• Authors of publication: Sheikh-Ali, B. M.; Rapta, M.; Jameson, G. B.; Weiss, R. G.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 5
• Pages of publication: 823 - 835
• a: 6.369 ± 0.003 Å
• b: 9.071 ± 0.003 Å
• c: 14.682 ± 0.004 Å
• α: 106.69 ± 0.02°
• β: 93.69 ± 0.03°
• γ: 93.33 ± 0.03°
• Cell volume: 808.2 ± 0.5 ų
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: Mo
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No