Ab initio and experimental thermodynamic and kinetic study of proton-assisted bond activation in gaseous hydrocarbons: Deconvolution of reaction efficiencies in the case of adamantane

Chemistry - A European Journal

Volumn 12, Issue 21, 2006, Pages 5505-5513

  Dávalos, Juan Z ^a   Herrero, Rebeca ^a   Quintanilla, Esther ^a,b   Jiménez, Pilar ^a   Gal, Jean François ^c   Maria, Pierre Charles ^c   Abboud, José Luis M ^a  

^a INSTITUTO DE QUÍMICA FÍSICA ROCASOLANO   (Spain)

^b ETH ZURICH   (Switzerland)

^c UNIVERSITÉ CÔTE D'AZUR   (France)

Author keywords

Ab initio calculations; Hydrocarbons; Ion molecule reactions; Kinetics protonation

Indexed keywords

BONDING; CYCLOTRON RESONANCE; FOURIER TRANSFORM INFRARED SPECTROSCOPY; PROTONS; RATE CONSTANTS; REACTION KINETICS; THERMODYNAMIC PROPERTIES;

AB INITIO CALCULATIONS; FOURIER TRANSFORM ION CYCLOTRON RESONANCE (FT-ICR); ION-MOLECULE REACTIONS; KINETICS PROTONATION;

HYDROCARBONS;

EID: 33746454717     PISSN: 09476539     EISSN: 15213765     Source Type: Journal    
DOI: 10.1002/chem.200600029     Document Type: Article

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