A conformational study of 1-bromo-2-chloroethane in zeolites.
The conformational properties of 1-bromo-2-chloroethane (BCE) in several representative zeolites including silicalite-1, siliceous Y (Si-Y), Na-Y, and zeolite L have been investigated by FT-Raman spectroscopy in combination with thermogravimetric analysis. The results indicate that the conformational and dynamic behavior of BCE inside a zeoltic host is strongly influenced by several factors such as the framework topology, the Si/Al ratio, and the nature and the locations of charge-balancing cations. For siliceous zeolites (silicalite-1 and Si-Y), the anti population of BCE increases significantly relative to pure liquid upon initial loading at room temperature. Interestingly, when lowering temperature, the anti population of BCE in silicalite-1 continues to increase, but the conformational equilibrium of BCE inside Si-Y shifts to the gauche conformer. Zeolite L and Na-Y with extra-framework cations show an almost exclusive preference for the gauche mode of the BCE molecule at room temperature, and the conformational population does not change significantly at low temperatures.
Wang
Haiyan
H
Department of Chemistry, The University of Western Ontario, London, Ontario, Canada N6A 5B7.
Huang
Yining
Y