Information card for entry 7100830

Structure parameters

• Formula: C240 H160 N32
• Calculated formula: C15 H10 N2
• SMILES: n1c2n(c3ccccc3c3ccccc23)cc1
• Authors of publication: A. Parenty; K. Guthrie; L. Smith; E. Burkholder; L. Cronin
• Journal of publication: Chemical Communications
• Year of publication: 2006
• a: 11.4915 ± 0.0011 Å
• b: 12.2167 ± 0.0012 Å
• c: 16.0434 ± 0.0015 Å
• α: 90°
• β: 108.288 ± 0.005°
• γ: 90°
• Cell volume: 2138.5 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• 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