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- W2376467266 abstract "By using at density functional theory(DFT)at B3LYP/6-31G* levels,The morpholinium ionic liquid with different substituent length have been studied.The computed results indicate that the ionic liquid formed by N-methyl ethyl morpholinium and a chlorine ion has three structure(mon,nop,orth)and six position.Three hydrogen bond have been formed in each position,The hydrogen bond between chlorine ion and hydrogen atom in morpholinium ring is strongest and shortest.The hydrogen bond between chlorine ion and hydrogen atom in methyl or ethyl is weaker,which can strengthen the stability of ion pair.For N-methyl ethyl morpholinium,N-methyl propyl morpholinium and N-methyl butyl morpholinium,as the alkyl length becomes longer,the hydrogen bond length between chlorine ion and hydrogen atom in morpholinium ring becomes longer,the binding energy between chlorine ion and morpholinium with different alkyl length becomes weaker." @default.
- W2376467266 created "2016-06-24" @default.
- W2376467266 creator A5060323960 @default.
- W2376467266 date "2010-01-01" @default.
- W2376467266 modified "2023-09-25" @default.
- W2376467266 title "Influence of different substituent length on structure property of morpholinium ionic liquid" @default.
- W2376467266 hasPublicationYear "2010" @default.
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