Gas-Phase Ion-Molecule Reactions in Selected Cyclohexanes (PREPRINT)

Abstract

Ion-molecule reactions of cyclohexane, methylcyclohexane and ethylcyclohexane with hydrocarbon cations derived from these cyclohexanes, respectively, have been studied. These ion-molecule reactions take place via various channels including charge transfer, H- transfer, H2- transfer, H3- transfer, hydrocarbon anion transfer, and association with concerted fragmentation. Among these channels, H- transfer is the most prevalent, and for many of the reacting ions, it is the exclusive channel. Most of the reactions proceed in a direct mode, except for the reactions of C4H5+ or C4H7+ with cyclohexane, which in certain channels proceed via the formation of a long-lived collision complex. Some general trends in the reaction rates are observed: smaller reactant ions tend to exhibit faster reaction rates, and odd-electron ions react faster than the even-electron ions. For certain reactant ions, there is evidence of the existence of multiple structural isomers that have different reactivities.

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Document Details

Document Type
Technical Report
Publication Date
Dec 01, 2012
Accession Number
ADA573488

Entities

People

  • C. Q. Jiao
  • Steven Adams

Organizations

  • Air Force Research Laboratory

Tags

Communities of Interest

  • Energy and Power Technologies
  • Space

DTIC Thesaurus Topics

  • Air Force
  • Air Force Research Laboratories
  • Alkanes
  • Alkynes
  • Charge Transfer
  • Charged Particles
  • Chemical Reaction Properties
  • Chemical Synthesis
  • Chemistry
  • Cyclic Hydrocarbons
  • Cyclohexanes
  • Electrons
  • Hydrocarbons
  • Isomers
  • Mass Spectra
  • Molecules
  • Structural Isomers

Fields of Study

  • Chemistry

Readers

  • Organic Chemistry
  • Plasma Physics / Magnetohydrodynamics

Technology Areas

  • Microelectronics