Information card for entry 7050702

Structure parameters

• Formula: C13 H11 N
• Calculated formula: C13 H11 N
• SMILES: c1ccc(cc1)/C=C/c1ccncc1
• Authors of publication: Cariati, Elena; Galli, Simona; Macchi, Piero; Roberto, Dominique; Sironi, A.; Srdanov, Vojislav I.; Ugo, Renato
• Journal of publication: New Journal of Chemistry
• Year of publication: 2002
• a: 5.817 ± 0.004 Å
• b: 7.528 ± 0.005 Å
• c: 11.274 ± 0.008 Å
• α: 90°
• β: 93.26 ± 0.01°
• γ: 90°
• Cell volume: 492.9 ± 0.6 ų
• Cell temperature: 163 ± 2 K
• Ambient diffraction temperature: 163 ± 2 K
• Number of distinct elements: 3
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No