Hydrogen bonding between hydroxylic donors and MLCT-excited Ru(bpy)2(bpz)2+ complex: implications for photoinduced electron-proton transfer.

Sergei V LymarGerald F ManbeckDmitry E Polyansky

Published in: Chemical communications (Cambridge, England) (2019)

The equilibrium constants of the hydrogen bonding (HB) between hydroxylic donors, ROH, and an MLCT-excited Ru(bpy)2(bpz)2+ complex, 1(T), correlated with ROH empirical HB acidities, which could be used for evaluating the unimolecular rate constants of concerted electron-proton transfer within the H-bonded phenol-1(T) exciplexes.

Keyphrases

electron transfer
energy transfer
kidney transplantation
molecular dynamics
molecular dynamics simulations