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 |
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Format: | Journal |
Published: |
2018
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Subjects: | |
Online Access: | 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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Institution: | Chiang Mai University |
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