Information card for entry 4020296

Structure parameters

• Common name: 04218
• Formula: C25 H24 N2 O2
• Calculated formula: C25 H24 N2 O2
• SMILES: O1[C@H](C=C[C@@H]1N1C(=O)N([C@H]([C@H]1c1ccccc1)C)C)c1cccc2ccccc12
• Authors of publication: Craig R. Berry; Richard P. Hsung; Jennifer E. Antoline; Matthew E. Petersen; Rameshkumar Challeppan; Jessica A. Nielson
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 4038 - 4042
• a: 8.2006 ± 0.0016 Å
• b: 5.99 ± 0.0012 Å
• c: 20.888 ± 0.004 Å
• α: 90°
• β: 100.704 ± 0.003°
• γ: 90°
• Cell volume: 1008.2 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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