Determination of Reactivities by MO Theory (XI). Nucleophilic Substitution Reactions of N-Acetylpyrrolidone

MO 理論에 依한 反應性의 決定 (XI). N-아세틸피롤리돈의 親核性 置換反應

  • 이익춘 (仁荷大學校 理科大學 化學科) ;
  • 정대형 (仁荷大學校 理科大學 化學科) ;
  • 이석기 (釜山大學校 文理科大學 化學科) ;
  • 김시준 (釜山大學校 文理科大學 化學科)
  • Published : 1977.12.30

Abstract

The orbital mixing analysis was applied to the acid-catalyzed nucleophilic substitution reaction of N-acetylpyrrolidone. It was found that the reactivity of protonated carbonyl carbon is greatly enhanced due to increase in positive charge (for charge controlled reaction) and also increase in LUMO AO coefficient (for orbital controlled reaction) of the carbonyl carbon atom.

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References

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