Theoretical study of the relative reactivity of chloroethenes with atmospheric oxidants (OH, NO3, O(3P), Cl(2P) and Br(2P))

MARÝ´A T. BAUMGARTNER, RAU´L A. TACCONE, MARIANO A. TERUEL AND SILVIA I. LANE

ROYAL SOC CHEMISTRY

Año: 2002 vol. 4 p. 1028 - 1028

font face="AdvSTP_TIMR" size="1"> The reactivity of a series of chloroethenes with different electrophiles of tropospheric and stratospheric interest is analyzed by frontier molecular orbital theory and a correlation with calculated orbital energies is investigated. The reactions of CH2=CHCl; CH2=CCl2