Table 10. Theoretical Results for the Molecules Used in Homodesmic Reactions.

compound	ΔfHexp°(g, 298.15 K)	ΔfHpred°(g, 298.15 K)	Δ
coumarin	–176.8a	–176.8	0.0
1-methoxy-2-methylbenzene	–106.6 ± 1.6b	–109.5	–2.9
1-methoxy-3-methylbenzene	–102.6 ± 5.0b	–100.6	2.0
1-methoxy-4-methylbenzene	–99.0 ± 2.0b	–98.4	0.6
7-methoxycoumarin	–321.6 ± 2.8c	–319.7	1.9
benzene	82.9 ± 0.9d	83.5	–0.6
toluene	50.1 ± 1.1d	49.3	0.8
7M4MC	–383.6 ± 6.7e	–384.9	–1.3

^aTaken of ref (45).

^bTaken of ref (51).

^cTaken of ref (49).

^dTaken of ref (52).

^eExperimental value of this work.