University of Illinois Urbana-Champaign

Electronic Spectroscopy Of Mass-selected C7 H3+ And C7h3 Isomers In 6 k Neon Matrices

Maier, John P.

Content Files
RI03_Abstract.pdf
RI03_Abstract.txt
RI03_Presentation.pptx

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https://hdl.handle.net/2142/50988

Description

Title
Electronic Spectroscopy Of Mass-selected C7 H3+ And C7h3 Isomers In 6 k Neon Matrices
Author(s)
Maier, John P.
Contributor(s)
  • Fulara, Jan
  • Chakraborty, Arghya
Issue Date
2014-06-19
Keyword(s)
Matrix isolation (and droplets)
Date of Ingest
  • 2014-09-17T16:55:43Z
  • 2015-04-14T18:37:43Z
Abstract
Three open chain isomers of C$_7^{ }$H$_3^+$ including a three member carbon ring in the structure were identified in a neon matrix held at 6\,K using a mass-selected ion beam. Both indene and acyclic precursors were used in an ion source to produce the C$_7^{ }$H$_3^+$ cations which were codeposited with excess of neon to produce the matrix. The electronic absorption spectra were measured by the sensitive waveguide technique sampling around 10$^{16}$\,cm$^{-3}$ species. Some of the cations show well-resolved fluorescence. Some neutral C$_7$H$_3$ isomers are also detected in absorption produced in the matrix by photo-bleaching of the cations. The charge of the mass-selected species is experimentally established using presence of electron scavengers, release of electrons, changing the kinetic energy during deposition and precursor dependence, whereas the structure of the isomers is inferred by comparison of the energies of the transitions with CASPT2 calculations. The assignment is supported by comparison of the vibrational frequencies inferred from the spectra and theory. The first time identification of the electronic transitions of these structurally interesting isomers provides their means for their {\it in situ} monitoring in hydrocarbon combustion processes and formation of aromatics therein.
Publisher
International Symposium on Molecular Spectroscopy
Type of Resource
text
Genre of Resource
Conference Paper / Presentation
Language
English
Permalink
http://hdl.handle.net/2142/50988
DOI
https://doi.org/10.15278/isms.2014.RI03
Copyright and License Information
Copyright 2014 by the authors. Licensed under a Creative Commons Attribution 4.0 International License. http://creativecommons.org/licenses/by/4.0/

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Abstracts & Presentations - 2014 International Symposium on Molecular Spectroscopy PRIMARY