Information card for entry 4020998

Structure parameters

• Formula: C16 H20 N O3
• Calculated formula: C16 H19 N O3
• SMILES: [C@@H]1(CO[C@@H]2CCCC(=C/C(=O)OC)\N12)c1ccccc1
• Title of publication: Novel Routes to Chiral 2-Alkoxy-5-/6- methoxycarbonylmethylidenepyrrolidines/-piperidines
• Authors of publication: Olivier David; Sandrine Calvet; François Chau; Corinne Vanucci-Bacqué; Marie-Claude Fargeau-Bellassoued; Gérard Lhommet
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 2888 - 2891
• a: 5.3 ± 0.001 Å
• b: 8.545 ± 0.003 Å
• c: 15.757 ± 0.006 Å
• α: 90°
• β: 91.09°
• γ: 90°
• Cell volume: 713.5 ± 0.4 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No