Calculations of the change of total energy of the system, H++ HOO– to form H2O2, caused by the shift of ∠ OβOαHα and Hα–Oα bond length, have been performed; the results indicate a substantial stabilization of the transition state by the lone pairs on Oβ in HOO–.
Y. Kadoma, S. Tamagaki and S. Oae, J. Chem. Soc., Chem. Commun., 1972, 1115 DOI: 10.1039/C39720001115
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