Information card for entry 4100940

Structure parameters

• Formula: C30 H26 N2 O
• Calculated formula: C30 H26 N2 O
• SMILES: COc1ccc2nc(c(c(c2c1)c1ccc(cc1)N(C)C)c1ccccc1)c1ccccc1
• Authors of publication: Hiremath, Rupa; Swift, Jennifer A.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 9.5827 ± 0.0007 Å
• b: 11.8653 ± 0.0008 Å
• c: 12.0329 ± 0.0007 Å
• α: 65.548 ± 0.002°
• β: 67.047 ± 0.002°
• γ: 89.489 ± 0.002°
• Cell volume: 1127.7 ± 0.13 ų
• Cell temperature: 126 ± 2 K
• Ambient diffraction temperature: 126 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No