Information card for entry 4101208

Structure parameters

• Formula: C20 H29 N O3
• Calculated formula: C20 H29 N O3
• SMILES: O(C(=O)N1[C@@H](Cc2ccccc2)[C@H](O)[C@@H]2CCC[C@]12C)C(C)(C)C
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• a: 6.0661 ± 0.0006 Å
• b: 14.1382 ± 0.0016 Å
• c: 10.9152 ± 0.0015 Å
• α: 90°
• β: 92.357 ± 0.007°
• γ: 90°
• Cell volume: 935.34 ± 0.19 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 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