Information card for entry 2209886

Structure parameters

• Chemical name: Methyl N-[(2-hydroxynaphthalen-1-yl)(phenyl)methyl]carbamate
• Formula: C19 H17 N O3
• Calculated formula: C19 H17 N O3
• SMILES: COC(=O)NC(c1ccccc1)c1c(ccc2ccccc12)O
• Title of publication: Methyl <i>N</i>-[(2-hydroxynaphthalen-1-yl)(phenyl)methyl]carbamate
• Authors of publication: Bazgir, Ayoob; Amani, Vahid; Khavasi, Hamid Reza
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 8
• Pages of publication: o3533 - o3534
• a: 9.217 ± 0.003 Å
• b: 18.106 ± 0.005 Å
• c: 11.305 ± 0.004 Å
• α: 90°
• β: 121.11 ± 0.02°
• γ: 90°
• Cell volume: 1615.3 ± 1 ų
• Cell temperature: 294 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0703
• Weighted residual factors for all reflections included in the refinement: 0.1327
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes