Information card for entry 2004429

Structure parameters

• Formula: C24 H29 N O
• Calculated formula: C24 H29 N O
• SMILES: O=C1C[C@H](N([C@H]2[C@@H]1CCCC2)c1ccccc1)c1c(cc(cc1C)C)C.O=C1C[C@@H](N([C@@H]2[C@H]1CCCC2)c1ccccc1)c1c(cc(cc1C)C)C
• Title of publication: Two <i>cis</i> Ring-Fused <i>exo</i> <i>N</i>-Aryl Heterocycles: 1-Phenyl-2-(2,4,6-trimethylphenyl)decahydroquinolin-4-one and 1-(4-Trifluoromethylphenyl)-2-phenyldecahydroquinolin-4-one
• Authors of publication: Nogue, D.; Paugam, R.; Wartski, L.; Nierlich, M.; Vigner, D.; Lance, M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 1
• Pages of publication: 207 - 210
• a: 12.661 ± 0.003 Å
• b: 16.54 ± 0.005 Å
• c: 9.677 ± 0.002 Å
• α: 90°
• β: 101.57 ± 0.02°
• γ: 90°
• Cell volume: 1985.3 ± 0.9 ų
• Cell temperature: 294 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: 0.057
• Weighted residual factors for significantly intense reflections: 0.056
• Goodness-of-fit parameter for significantly intense reflections: 1.34
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No