J. Drujon

We don’t have enough information about this author to calculate their statistics. If you think this is an error let us know.
Learn More
The auto-oxidation of trans-1,2-disiloxybenzocyclobutene was found to be very efficient, giving endo-peroxide in quantitative yield. Each step of the mechanism of spin-forbidden addition of triplet oxygen O2((3)Σg) was studied by both EPR/spin trapping and theoretical studies.
Pseudopotentials for hybridized atoms are extracted and combined. The study focuses on sp(2) carbon atoms and their combination to give rise to a π electronic system. As electrons of interest are treated explicitly, any ab initio method can be used, thus, configuration interaction methods and time-dependent density functional theory are used and compared.(More)
  • 1