Information card for entry 4020397

Structure parameters

• Formula: C20 H14 N2
• Calculated formula: C20 H14 N2
• SMILES: n12c(ncc1)c(c1c3c(Cc1c2)cccc3)c1ccccc1
• Title of publication: Synthesis of Indeno-Fused Derivatives of Quinolizinium Salts, Imidazo[1,2-a]pyridine, Pyrido[1,2-a]indole, and 4H-Quinolizin-4-one via Benzannulated Enyne-Allenes
• Authors of publication: Weixiang Dai; Jeffrey L. Petersen; Kung K. Wang
• Journal of publication: Journal of Organic Chemistry
• Year of publication: 2005
• Journal volume: 70
• Pages of publication: 6647 - 6652
• a: 12.1159 ± 0.0012 Å
• b: 11.3755 ± 0.0011 Å
• c: 10.6198 ± 0.001 Å
• α: 90°
• β: 95.253 ± 0.002°
• γ: 90°
• Cell volume: 1457.5 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 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