Structure and stability of ammonium-sulfate and guanidium-sulfate complex

De Cai Fang, P. Fabian, Zoltan Szekely, Xiao Yuan Fu, Ting Hua Tang, Imre G. Csizmadia

Research output: Article

2 Citations (Scopus)

Abstract

Ab initio (HF/6-31G** and B3LYP/6-31 + + G**) methods have been used to study the stability and structure of complexes between CH3SO-3 and CH3NH3+ or C(NH2)+3. Results show that no hydrogen jump is involved in the complex formations, which is different from previous work studying complexes between CH3COO- and CH3NH+3. In addition, we have studied complexes between CH3SO-3 and HC(NH2)+3 or +H3NC(NH2)3, all of which have a cage structure.

Original languageEnglish
Pages (from-to)161-170
Number of pages10
JournalJournal of Molecular Structure: THEOCHEM
Volume430
Issue number1-3
DOIs
Publication statusPublished - ápr. 14 1998

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ASJC Scopus subject areas

  • Biochemistry
  • Condensed Matter Physics
  • Physical and Theoretical Chemistry

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