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. 2012 Aug 3;17(8):9321–9334. doi: 10.3390/molecules17089321

Table 3.

NBO charge of the acidic protons of the compound 5c calculated at the DFT/B3LYP level of theory.

Hi Charge
H3 0.25
H5 0.22
H12 0.39
H14 0.22