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Title: Conditions and Edges for the Photochemical Generation of Short-Lived Aryl Cations: A Computational Approach      
dateReleased:
04-22-2015
privacy:
information not avaiable
aggregation:
instance of dataset
dateCreated:
04-22-2015
refinement:
curated
ID:
doi:10.4125/PD0062TH
creators:
Raviola, Carlotta
Ravelli, Davide
Protti, Stefano
Albini, Angelo
Fagnoni, Maurizio
availability:
available
types:
other
description:
A DFT investigation on the conditions required for the photochemical generation of triplet aryl cations from differently para-substituted aryl halides has been carried out. The results showed a correlation between the energy change associated with the Ar–X bond heterolytic cleavage and the substituent Hammett–Brown constant (σp +). The method provides a means to predict the viability of the ArSN1 photosubstitution reaction.
accessURL: https://doi.org/10.4125/PD0062TH
storedIn:
© Georg Thieme Verlag
qualifier:
not compressed
format:
HTML
accessType:
landing page
authentication:
none
authorization:
none
abbreviation:
Thieme Chemistry
homePage: https://www.thieme.de/
ID:
SCR:SCR_014699
name:
Thieme Chemistry

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