A B3LYP/6-31+G(d) study of the reaction pathways and conformational preference in a model Chichibabin reaction

Research output: Contribution to journalArticlepeer-review

Original languageEnglish
Pages (from-to)191-199
Number of pages9
JournalComputational and Theoretical Chemistry
Volume963
Issue number1
DOIs
StatePublished - Jan 2011

ASJC Scopus Subject Areas

  • Biochemistry
  • Condensed Matter Physics
  • Physical and Theoretical Chemistry

Keywords

  • Chichibabin reaction
  • DFT studies
  • Gaussian
  • Mechanism
  • Pyridines

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