Information card for entry 4020968

Structure parameters

• Formula: C21 H22 N2 O4 S
• Calculated formula: C21 H22 N2 O4 S
• SMILES: S(=O)(=O)(N1c2c([C@H]3C[C@H](N([C@@H]13)C(=O)OC)CC=C)cccc2)c1ccccc1
• Title of publication: Endo-Selective Quenching of Hexahydropyrrolo[2,3-b]indole-Based N-Acyliminium Ions
• Authors of publication: Rosa L. Meza-León; David Crich; Sylvain Bernès; Leticia Quintero
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 3976 - 3978
• a: 8.509 ± 0.0007 Å
• b: 11.593 ± 0.0008 Å
• c: 20.2321 ± 0.0013 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1995.8 ± 0.2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• 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