Information card for entry 3000603

Structure parameters

• Chemical name: benzyl ((2S,4S)-2-(4-chlorophenyl)-6-methoxy-1,2,3,4-tetrahydroquinolin-4-yl)carbamate
• Formula: C24 H23 Cl N2 O3
• Authors of publication: Rakovský, Erik; Kisszekelyi, Péter; Doblejová, Terézia; Šebesta, Radovan
• Journal of publication: To be published in Chemical Communications
• a: 8.7549 ± 0.0004 Å
• b: 4.8924 ± 0.0002 Å
• c: 24.0363 ± 0.0011 Å
• α: 90°
• β: 95.493 ± 0.004°
• γ: 90°
• Cell volume: 1024.81 ± 0.08 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0362
• Residual factor for significantly intense reflections: 0.0354
• Weighted residual factors for significantly intense reflections: 0.092
• Weighted residual factors for all reflections included in the refinement: 0.0938
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54186 Å
• Diffraction radiation type: CuKα
• Has coordinates: No
• Has disorder: No
• Has Fobs: No