Information card for entry 4020396

Structure parameters

• Formula: C22 H25 Cl N2
• Calculated formula: C22 H25 Cl N2
• SMILES: [Cl-].[n+]12c(c(c3c4c(Cc3c2)cccc4)C(C)(C)C)cc(N(C)C)cc1
• 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: 10.626 ± 0.0016 Å
• b: 20.419 ± 0.003 Å
• c: 9.0204 ± 0.0012 Å
• α: 90°
• β: 108.971 ± 0.003°
• γ: 90°
• Cell volume: 1850.8 ± 0.5 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• 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