. 2021 Mar 12;11(18):10727–10737. doi: 10.1039/d1ra00690h

Analysis of the total amount of pairwise nearest and non-nearest neighbour interactions of substituents on the “centerpieces” in terms of Δ^g_lH^o_m for trimethoxy-substituted benzenes at 298.15 K (in kJ mol⁻¹).

Compound	Δ^g_lH^o_m^a	Actual amount of interactions^b	Theoretical amount of interactions^b	Δ ^c
1	2	3	4	5
1,2,3-Trimethoxybenzene	73.0 ± 0.7	1.6	12.0	−10.4
1,2,4-Trimethoxybenzene	75.9 ± 0.7	4.5	9.1	−4.6
1,3,5-Trimethoxybenzene	68.7 ± 0.8	−2.7	2.4	−5.1
3,4,5-Trimethoxytoluene	77.7 ± 0.7	2.1	19.1	−17.0

Results from Tables 1 and 2.

Calculated in Table S17.

Difference between columns 3 and 4.

Analysis of the total amount of pairwise nearest and non-nearest neighbour interactions of substituents on the “centerpieces” in terms of ΔglHom for trimethoxy-substituted benzenes at 298.15 K (in kJ mol−1).