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Intramolecular Vibrational Energy Redistribution in 2‑Thiocytosine: SH Rotamerization Induced by Near-IR Selective Excitation of NH2 Stretching Overtone Anna Halasa, Leszek Lapinski, Hanna Rostkowska, and Maciej J. Nowak* Institute of Physics, Polish Academy of Sciences, Al. Lotnikow 32/46, 02-668 Warsaw, Poland

Downloaded by FLORIDA ATLANTIC UNIV on September 3, 2015 | http://pubs.acs.org Publication Date (Web): August 20, 2015 | doi: 10.1021/acs.jpca.5b06221

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ABSTRACT: Near-IR-induced transformations, converting one amino-thiol conformer of 2-thiocytosine into another, were observed for monomers of the compound isolated in Ne, Ar, and N2 low-temperature matrixes. The two conformers involved in this phototransformation differ from each other by 180° rotation of the SH group. To induce the conversion, conformers of 2-thiocytosine were selectively excited to the overtone (or combination) NH2 stretching vibrational states, using very narrowband (fwhm