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. 2022 Mar 18;126(12):1936–1945. doi: 10.1021/acs.jpca.1c10815

Table 4. Strength of the Diatropic and Paratropic Contributions to the Strength of the Current Density (in nA·T–1) Passing Different Planes of Molecule 4.

plane diatropic paratropic net
neutral
4A 16.8 –6.7 10.1
4B 14.5 –8.0 6.5
4C 4.9 –30.3 –25.4
4D 5.2 –218.0 –212.8
dication
4A 5.9 –20.4 14.4
4B 15.1 –7.6 7.5
4C 4.5 –32.0 –27.5
4D 19.5 –20.4 –0.9