An investigation of the template effects in the synthesis of monobenzo-15-crown-5 ether by molecular dynamics simulation

Weon Seok Oh, Myung Hee Kwon, Su Yeon Kim, Kyoung Tai No, Suk Kyu Chang

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Abstract

The molecular dynamics simulations of the template effects of alkali metal cations for the synthesis of monobenzo-15-crown-5 were performed. The simulation results qualitatively duplicate the experimental results and Na+ ion was found to be the best template ion among alkali metal cations.

Original languageEnglish
Pages (from-to)181-182
Number of pages2
JournalChemistry Letters
Issue number3
DOIs
Publication statusPublished - 1996 Jan 1

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All Science Journal Classification (ASJC) codes

  • Chemistry(all)

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