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reaction mechanisms:
How are Reaction Mechanisms Determined?
Determining reaction mechanisms often involves a combination of
experimental techniques
and
theoretical calculations
. Techniques such as
spectroscopy
,
kinetic studies
, and
isotopic labeling
provide experimental evidence for proposed mechanisms. Computational methods, including
quantum mechanics
and
molecular dynamics simulations
, are used to model the reaction pathways and predict the behavior of intermediates and transition states.
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