Article ID Journal Published Year Pages File Type
5382563 Chemical Physics Letters 2013 7 Pages PDF
Abstract
► Compared to PhOH, the first ππ∗ transition of PhOH(H+) is slightly red shifted. ► In para-F-PhOH(H+), the red shift effect is more significant than the bare phenol. ► The first πσ∗ state of protonated phenol lies in 7A″ state and amounts to 8.29 eV.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Authors
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