Aluminium, not the halogen atom, is the preferred protonation site in AlCl and AlBr
High-level quantum chemical calculations on the [AlHF]+ potential energy surface identify HAlF+ and AlFH+, two isoenergetic isomers (Erel(HAlF+)≅0±5 kJ mol-1) separated by a large barrier (Erel(TS)=245 kJ mol-1). While barriers of similar magnitude obs
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|Source:||Chemical Physics Letters|
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