Construct · 1 fields · 1 citations

activation strain model: a standalone construct

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Computational chemistry

an analysis splitting a reaction barrier into the energy to distort reactants and the interaction energy between the distorted fragments.

In computational chemistry, activation strain model refers to an analysis splitting a reaction barrier into the energy to distort reactants and the interaction energy between the distorted fragments. This meaning comes from Bickelhaupt (2017) in Angewandte Chemie International Edition.[1]

Unit
Recovery means
Measured by

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Nearby constructs

activation4 fields · 4 citationsjingle · one word, four constructs barrier4 fields · 7 citationsjingle · one word, four constructs energy5 fields · 10 citationsjingle · one word, five constructs

References

Bickelhaupt, F. M., & Houk, K. N. (2017). Analyzing Reaction Rates with the Distortion/Interaction‐Activation Strain Model. Angewandte Chemie International Edition, 56(34), 10070-10086. https://doi.org/10.1002/anie.201701486

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