Information card for entry 4101040

Structure parameters

• Formula: C25 H25 N O3
• Calculated formula: C25 H25 N O3
• SMILES: c1(cc2ccccc2cc1)[C@@H](C)NC(=O)[C@@](O)(C)[C@]1(O[C@@H]1C=C)c1ccccc1
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2006
• a: 5.9391 ± 0.0003 Å
• b: 8.0487 ± 0.0004 Å
• c: 22.2075 ± 0.0016 Å
• α: 92.264 ± 0.002°
• β: 92.001 ± 0.002°
• γ: 90.067 ± 0.004°
• Cell volume: 1060.08 ± 0.11 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 4
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No