Stepwise double excited-state proton transfer is not possible in 7-azaindole dimer
© The Royal Society of Chemistry 2015. The nature of the excited-state double proton transfer in 7-azaindole (7AI) dimer - whether it is stepwise or concerted - has been under a fierce debate for two decades. Based on high-level computational simulations of static and dynamic properties, we show tha...
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Main Authors: | Rachel Crespo-Otero, Nawee Kungwan, 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=84941702199&origin=inward http://cmuir.cmu.ac.th/jspui/handle/6653943832/44298 |
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Institution: | Chiang Mai University |
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