Microwave spectra, density functional theory calculations and molecular structure of acetylenemethyldioxorhenium

S. G. Kukolich, B. J. Drouin, O. Indris, J. J. Dannemiller, J. P. Zoller, W. A. Herrmann

Research output: Contribution to journalArticle

5 Scopus citations

Abstract

The rotational spectra of 14 isotopomers was used to investigate the molecular structure of acetylenemethyldioxorhenium. The catalyzed reactions of methyltrioxorhenium and osmium tetroxide related the complex to its intermediates. Microwave spectrometers of the Flygare-Balle type were used for the structural analysis. The rotational constants were found in correlation with the density functional theory.

Original languageEnglish (US)
Pages (from-to)7891-7900
Number of pages10
JournalJournal of Chemical Physics
Volume113
Issue number18
DOIs
StatePublished - Nov 8 2000

ASJC Scopus subject areas

  • Physics and Astronomy(all)
  • Physical and Theoretical Chemistry

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