Journal of Physical Chemistry A, Vol.115, No.47, 13931-13941, 2011
Electronic Transition Moment for the 0(0)(0) Band of the (A)over-tilde <- (X)over-tilde Transition in the Ethyl Peroxy Radical
The electronic transition moment for the G-conformer of ethyl peroxy was determined from the experimentally measured value of the peak absorption cross-section and the simulation of its rovibronic spectrum using the results of the high resolution spectroscopy of this molecule. The resulting value is |mu(G)(e)| = 2.55(6) x 10(-2) Debye, which is compared to values from electronic structure calculations.