AN INVESTIGATION OF THE TEMPLATE EFFECTS IN THE SYNTHESIS OF MONOBENZO-15-CROWN-5 ETHER BY MOLECULAR-DYNAMICS SIMULATION

Authors
OH WS KWON MH KIM SY NO KT CHANG SK
Citation
Ws. Oh et al., AN INVESTIGATION OF THE TEMPLATE EFFECTS IN THE SYNTHESIS OF MONOBENZO-15-CROWN-5 ETHER BY MOLECULAR-DYNAMICS SIMULATION, Chemistry Letters, (3), 1996, pp. 181-182
Citations number
7
Categorie Soggetti
Chemistry
Journal title
Chemistry Letters → ACNP
ISSN journal
03667022
Issue
3
Year of publication
1996
Pages
181 - 182
Database
ISI
SICI code
0366-7022(1996):3<181:AIOTTE>2.0.ZU;2-6
Abstract
The molecular dynamics simulations of the template effects of alkali m etal cations for the synthesis of monobenzo-15-crown-5 were performed. The simulation results qualitatively duplicate the experimental resul ts and Na+ ion was found to be the best template ion among alkali meta l cations.