Information card for entry 4021297

Structure parameters

• Formula: C17 H18 N2 O3 S2
• Calculated formula: C17.016 H18 N2 O3 S2.004
• Title of publication: New Resolution of 2-Formyl-1,4-DHP Derivatives Using CIDR Methodology. Facile Access to New Chiral Tricyclic Thiolactam
• Authors of publication: Štefan Marchalín; Katarína Cvopová; Miroslav Križ; Peter Baran; Hassan Oulyadi; Adam Daïch
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2004
• Journal volume: 69
• Pages of publication: 4227 - 4237
• a: 11.1094 ± 0.0016 Å
• b: 14.2 ± 0.002 Å
• c: 11.8055 ± 0.0016 Å
• α: 90°
• β: 110.927 ± 0.003°
• γ: 90°
• Cell volume: 1739.5 ± 0.4 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No