Synthesis and Crystal Structure of 1,2,4,6-Tetraphenyl-2-hydroxy-8-azabicycle[3,2,1]octane  

作　　者：席简忠 江建平 等 

出　　处：《Chinese Journal of Structural Chemistry》2001年第4期259-261,共3页结构化学（英文）

摘　　要：The title compound (C31H29NO, Mr = 431.6) was synthesized and its crystal structure was determined by X-ray diffraction method. It crystallized in orthorhombic space group Pcab, with cell parameters: a = 10.579 (3), b = 18.514(7) , c = 23.93(1) ?, V = 4686.22(3) ?3, Z = 8, Dc = 1.223g/cm3, F(000) = 1840, μ = 0.68mm-1. The structure was solved by direct methods and refined by full-matrix least-squares method, and final R = 0.057, Rw = 0.060 for 2282 observed reflections with I ≥3.00σ(I). The molecular backbone is aza-bicycle [3,2,1]octane containing a chair-like six-membered aza-cycle conformation.The title compound (C31H29NO, Mr = 431.6) was synthesized and its crystal structure was determined by X-ray diffraction method. It crystallized in orthorhombic space group Pcab, with cell parameters: a = 10.579 (3), b = 18.514(7) , c = 23.93(1) ?, V = 4686.22(3) ?3, Z = 8, Dc = 1.223g/cm3, F(000) = 1840, μ = 0.68mm-1. The structure was solved by direct methods and refined by full-matrix least-squares method, and final R = 0.057, Rw = 0.060 for 2282 observed reflections with I ≥3.00σ(I). The molecular backbone is aza-bicycle [3,2,1]octane containing a chair-like six-membered aza-cycle conformation.

关 键 词：crystal structure aza-bicycle[3 2 1]octane chair-like conformation 

分 类 号：O626[理学—有机化学]