UV-VIS spectroscopic and theoretical studies about carbocation formation on solid surfaces

I. Kiricsi, G. Tasi, H. Förster, P. Fejes

Research output: Contribution to journalArticle

6 Citations (Scopus)

Abstract

Generation and transformation of alkenyl carbenium ions formed upon adsorption of hydrocarbons in zeolites were investigated by UV-VIS spectroscopy. Bands generally observed in the ranges of 290-320, 350-370 and 430-460 nm were assigned to mono-, di- and trienylic carbenium ions. Characteristic band shifts of the alkenyl carbenium ions to the higher wavelengths were found, due to the formation of branched, i.e. more stable carbenium ions. Standard heats of formation, obtained from semiempirical methods showed that with increasing alkyl substitution the stability of carbenium ions increases. The π-π{black star} MO distances computed are in accordance with the experimentally observed shifts of the band maxima.

Original languageEnglish
Pages (from-to)369-374
Number of pages6
JournalJournal of Molecular Structure
Volume218
Issue numberC
DOIs
Publication statusPublished - 1990

Fingerprint

solid surfaces
Theoretical Models
Ions
ions
Zeolites
shift
heat of formation
Hydrocarbons
Ultraviolet spectroscopy
zeolites
Adsorption
Stars
Spectrum Analysis
Substitution reactions
hydrocarbons
Hot Temperature
substitutes
stars
Wavelength
adsorption

ASJC Scopus subject areas

  • Structural Biology
  • Organic Chemistry
  • Physical and Theoretical Chemistry
  • Spectroscopy
  • Materials Science (miscellaneous)
  • Atomic and Molecular Physics, and Optics

Cite this

UV-VIS spectroscopic and theoretical studies about carbocation formation on solid surfaces. / Kiricsi, I.; Tasi, G.; Förster, H.; Fejes, P.

In: Journal of Molecular Structure, Vol. 218, No. C, 1990, p. 369-374.

Research output: Contribution to journalArticle

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