Information card for entry 4020574

Structure parameters

• Formula: C18 H21 N O3
• Calculated formula: C17 H21 N O3
• SMILES: COC(=O)C1=C(C)N2[C@](CC1)(C)OC[C@@H]2c1ccccc1
• Title of publication: Synthesis of New Chiral 6-Carbonyl 2,3,8,8a-Tetrahydro-7H-oxazolo[3,2-a]pyridines
• Authors of publication: Romain Noël; Corinne Vanucci-Bacqué; Marie-Claude Fargeau-Bellassoued; Gérard Lhommet
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 9044 - 9047
• a: 5.9101 ± 0.0004 Å
• b: 14.4928 ± 0.0014 Å
• c: 17.659 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1512.6 ± 0.2 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No