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Title: A discharge flow-photoionization mass spectrometric study of HOBr([ital X] [sup 1][ital A][prime]): Photoion yield spectrum, ionization energy, and thermochemistry

Journal Article · · Journal of Chemical Physics; (United States)
DOI:https://doi.org/10.1063/1.466543· OSTI ID:5285256
;  [1];  [2]; ;  [3]
  1. Laboratory for Extraterrestrial Physics, NASA/Goddard Space Flight Center, Greenbelt, Maryland 20771 (United States)
  2. Center for Advanced Research in Biotechnology, NIST, Rockville, Maryland 20850 (United States)
  3. DAS-815, Brookhaven National Laboratory, Upton, New York 11973-5000 (United States)

The photoion yield spectrum of HOBr was measured over the wavelength range [lambda]=108--121 nm by using a discharge flow-photoionization mass spectrometer apparatus coupled to a synchrotron radiation source. HOBr was generated by the reaction of OH with molecular bromine. A value of (10.62[plus minus]0.04) eV was obtained for the adiabatic ionization energy (I.E.) of HOBr from photoion thresholds, corresponding to the HOBr[sup +]([sup 2][ital A][double prime])[l arrow]HOBr([sup 1][ital A][prime]) transition. The structure observed in the spectrum is discussed in terms of the available states for HOBr[sup +], which have been determined using multiconfiguration-self-consistent field calculations. A new value for [Delta][ital H][sup 0][sub [ital f] 298](HOBr) of [minus]9 kcal mol[sup [minus]1] is derived from I.E.(HOBr) and estimates of [Delta][ital H][sub [ital f]](HOBr[sup +]).

DOE Contract Number:
AC02-76CH00016
OSTI ID:
5285256
Journal Information:
Journal of Chemical Physics; (United States), Vol. 100:3; ISSN 0021-9606
Country of Publication:
United States
Language:
English