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. 2017 Oct 17;22(10):1744. doi: 10.3390/molecules22101744

Table 10.

Selected local reactivity parameters of IIII.

Atom f Pk P+k Nk ωk
I II III I II III I II III I II III I II III
C11 0.030 0.020 0.060 0.010 0.030 0.010 0.020 −0.040 0.010 −0.140 0.280 −0.070 0.050 0.220 0.030
C12 −0.010 0.080 0.010 0.000 −0.010 0.000 0.010 0.010 0.000 −0.030 −0.050 0.020 0.010 −0.070 0.030
C13 −0.010 −0.170 0.010 −0.010 0.010 0.000 0.020 0.000 0.000 −0.140 −0.030 −0.010 −0.050 0.040 0.020
C14 −0.030 0.030 0.070 0.010 0.010 0.000 0.030 0.000 −0.060 −0.210 −0.010 0.390 0.040 0.090 −0.030
C15 −0.010 0.230 −0.030 0.020 −0.010 −0.010 0.040 −0.030 0.000 −0.280 0.210 −0.010 0.130 −0.030 −0.040
C16 0.000 −0.040 0.020 0.040 0.010 0.000 0.020 0.060 −0.010 −0.140 −0.420 0.040 0.260 0.030 −0.010