Figure 13.
Stationary points on the energy surface for electrocyclic ring opening of 5d. B3LYP/6-31G(d) thermal energies, ΔH, with thermally corrected M06-2X/6-311++G(d,p)//B3LYP/6-31G(d) energies, ΔH, in parentheses, shown in kcal/mol.
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