Theoretical study on excited-state intermolecular proton transfer reactions of 1H-pyrrolo[3,2-h]quinoline with water and methanol

The dynamics of the ultrafast excited-state multiple intermolecular proton transfer (PT) reactions in gas-phase complexes of 1H-pyrrolo[3,2-h]quinoline with water and methanol (PQ(H2O)n and PQ(MeOH)n, where n=1,2)ismodeledusingquantum-chemicalsimulations. The minimum energy ground-state structures o...

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Main Authors: Nawee Kungwan, Rathawat Daengngern, Tammarat Piansawan, Supa Hannongbua, Mario Barbatti
格式: 雜誌
出版: 2018
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在線閱讀:https://www.scopus.com/inward/record.uri?partnerID=HzOxMe3b&scp=84891383599&origin=inward
http://cmuir.cmu.ac.th/jspui/handle/6653943832/52365
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機構: Chiang Mai University