Origin of the individual basicity of rorrole NH-tautomers: A quantum chemical study o molecular structure and dynamics, kientics, and thermodynamics

Beenken, WichardWichardBeenkenMaes, WouterWouterMaesKruk, MikalaiMikalaiKrukMartinez, ToddToddMartinezPresselt, MartinMartinPresselt2021-10-222021-10-2220151089-5639https://imec-publications.be/handle/20.500.12860/24973Origin of the individual basicity of rorrole NH-tautomers: A quantum chemical study o molecular structure and dynamics, kientics, and thermodynamicsJournal article10.1021/acs.jpca.5b02869http://pubs.acs.org/doi/abs/10.1021/acs.jpca.5b02869