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. 2022 Dec 6;27(23):8590. doi: 10.3390/molecules27238590

Figure 3.

Figure 3

Isosurface of electrostatic potential plotted at a value of 0.0004 of phenol (top) and phenate (bottom) with: 0 (a,a’), 1 (b,b’), 2 (c,c’) explicit water molecules. Calculations were performed with CAM-B3LYP/6-311G+dp/SMD level of theory.