WATER-NETWORK MEDIATED, ELECTRON INDUCED PROTON TRANSFER IN ANIONIC [C5H5N·(H2O)n]− CLUSTERS: SIZE DEPENDENT FORMATION OF THE PYRIDINIUM RADICAL FOR n ≥ 3
DeBlase, Andrew F.
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https://hdl.handle.net/2142/79257
Description
Title
WATER-NETWORK MEDIATED, ELECTRON INDUCED PROTON TRANSFER IN ANIONIC [C5H5N·(H2O)n]− CLUSTERS: SIZE DEPENDENT FORMATION OF THE PYRIDINIUM RADICAL FOR n ≥ 3
Author(s)
DeBlase, Andrew F.
Contributor(s)
Johnson, Mark
Jordan, Kenneth D.
Archer, Kaye A
Weddle, Gary H
Issue Date
24-Jun-15
Keyword(s)
Clusters/Complexes
Abstract
As an isolated species, the radical anion of pyridine (Py$^{-}$) exists as an unstable transient negative ion, while in aqueous environments it is known to undergo rapid protonation to form the neutral pyridinium radical [PyH$^{(0)}$] along with hydroxide. Furthermore, the negative adiabatic electron affinity (AEA) of Py$^{-}$ can become diminished by the solvation energy associated with cluster formation. In this work, we focus on the hydrates [Py$cdot$(H$_{2}$O)$_{n}$]$^{-}$ with n = 3-5 and elucidate the structures of these water clusters using a combination of vibrational predissociation and photoelectron spectroscopies. We show that H-trasfer to form PyH$^{(0)}$ occurs in these clusters by the infrared signature of the nascent hydroxide ion and by the sharp bending vibrations of aromatic ring CH bending.
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