Information card for entry 7100813

Structure parameters

• Formula: C23 H27 N O5
• Calculated formula: C23 H27 N O5
• SMILES: O(C)C(=O)[C@@]1(CCCC1=O)[C@@H](c1cc2c(cc1)cccc2)NC(=O)OC(C)(C)C
• Title of publication: Direct Enantio- and Diastereoselective Mannich Reactions of Malonate and a-Keto Esters with N-Boc- and N-Cbz-Aldimines Catalysed by a Bifunctional Cinchonine Derivative
• Authors of publication: Darren J. Dixon; A. Louise Tillman; Jinxing Ye.
• Journal of publication: Chemical Communications
• Year of publication: 2006
• a: 10.8665 ± 0.0003 Å
• b: 11.1927 ± 0.0003 Å
• c: 34.5493 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4202.1 ± 0.2 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 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