Information card for entry 2020453

Structure parameters

• Chemical name: (<i>S</i>)-(+)-2-{[(1-Phenylethyl)imino]methyl}naphthalene
• Formula: C19 H17 N
• Calculated formula: C19 H17 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: 14.9328 ± 0.0002 Å
• b: 6.01143 ± 0.0001 Å
• c: 33.9985 ± 0.0007 Å
• α: 90°
• β: 102.601 ± 0.0017°
• γ: 90°
• Cell volume: 2978.45 ± 0.09 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: 0.0543
• Residual factor for significantly intense reflections: 0.0392
• Weighted residual factors for significantly intense reflections: 0.0829
• Weighted residual factors for all reflections included in the refinement: 0.092
• Goodness-of-fit parameter for all reflections included in the refinement: 1.036
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes