Information card for entry 2020460

Structure parameters

• Chemical name: (<i>S</i>)-(+)-2-{[(1-Cyclohexylethyl)imino]methyl}naphthalene
• Formula: C19 H23 N
• Calculated formula: C19 H23 N
• SMILES: N(=C\c1cc2ccccc2cc1)/[C@@H](C)C1CCCCC1
• Title of publication: Crystal structures of ten enantiopure Schiff bases bearing a naphthyl group
• Authors of publication: Hernández-Téllez, Guadalupe; Moreno, Gloria E.; Bernès, Sylvain; Mendoza, Angel; Portillo, Oscar; Sharma, Pankaj; Gutiérrez, René
• Journal of publication: Acta Crystallographica Section E Crystallographic Communications
• Year of publication: 2016
• Journal volume: 72
• Journal issue: 4
• Pages of publication: 583
• a: 15.406 ± 0.003 Å
• b: 5.9722 ± 0.0007 Å
• c: 36.002 ± 0.007 Å
• α: 90°
• β: 102.058 ± 0.018°
• γ: 90°
• Cell volume: 3239.4 ± 1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1929
• Residual factor for significantly intense reflections: 0.0782
• Weighted residual factors for significantly intense reflections: 0.1573
• Weighted residual factors for all reflections included in the refinement: 0.2306
• Goodness-of-fit parameter for all reflections included in the refinement: 0.993
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes