HIGH-RESOLUTION INFRARED SPECTROSCOPY SLIT-JET COOLED HYDROXYMETHYL RADICAL (CH2OH): CH SYMMETRIC STRETCHING MODE
Author(s) -
Fang Wang,
David J. Nesbitt,
Chih-Hsuan Chang
Publication year - 2014
Publication title -
proceedings of the 74th international symposium on molecular spectroscopy
Language(s) - English
Resource type - Conference proceedings
DOI - 10.15278/isms.2014.te01
Subject(s) - hydroxymethyl , infrared spectroscopy , spectroscopy , infrared , resolution (logic) , materials science , slit , jet (fluid) , chemistry , optics , physics , organic chemistry , computer science , artificial intelligence , thermodynamics , quantum mechanics
Hydroxymethyl radical (CH2OH) plays an important role in combustion and environmental chemistry as a reactive intermediate. Reisler’s group publisheda the first rotationally resolved spectroscopy of CH2OH with determined band origins for fundamental CH symmetric stretch state, CH asymmetric stretch state and OH stretch state, respectively. Here CH2OH was first studied via sub-Doppler infrared spectroscopy in a slit-jet supersonic discharge expansion source. Rotationally resolved direct absorption spectra in the CH symmetric stretching mode were recorded. As a result of the low rotational temperature and sub-Doppler linewidths, the tunneling splittings due to the large amplitude of COH torsion slightly complicate the spectra. Each of the ground vibration state and the CH symmetric stretch state includes two levels. One level, with a 3:1 nuclear spin statistic ratio for Ka=0/Ka=1, is labeled as “+”. The other tunneling level, labeled as “-”, has Ka=0/Ka=1 states with 1:3 nuclear spin statistics. Except for the Ka=0 ← 0 band published before b, more bands (Ka=1← 1 , Ka=0← 0− and Ka=1← 1−) were identified. The assigned transitions were fit to a Watson A-reduced symmetric top Hamiltonian to improve the accuracy of the band origin of CH symmetric state. The rotational parameters for both ground and CH symmetric stretch state were well determined.
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