Information card for entry 4060616

Structure parameters

• Formula: C20 H21 N3
• Calculated formula: C20 H21 N3
• SMILES: [C]1N(C=CN1C(=N/c1ccccc1)/c1ccccc1)C(C)(C)C
• Authors of publication: Coleman, Karl
• Journal of publication: Organometallics
• Year of publication: 2006
• a: 14.1279 ± 0.0015 Å
• b: 5.8199 ± 0.0006 Å
• c: 20.954 ± 0.002 Å
• α: 90°
• β: 104.181 ± 0.004°
• γ: 90°
• Cell volume: 1670.4 ± 0.3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No