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  2. Transition state theory - Wikipedia

    en.wikipedia.org/wiki/Transition_state_theory

    It offers a concrete interpretation of the pre-exponential factor A in the Arrhenius equation; for a unimolecular, single-step process, the rough equivalence A = (k B T/h) exp(1 + ΔS ‡ /R) (or A = (k B T/h) exp(2 + ΔS ‡ /R) for bimolecular gas-phase reactions) holds. For a unimolecular process, a negative value indicates a more ordered ...

  3. Eyring equation - Wikipedia

    en.wikipedia.org/wiki/Eyring_equation

    The Eyring equation (occasionally also known as Eyring–Polanyi equation) is an equation used in chemical kinetics to describe changes in the rate of a chemical reaction against temperature. It was developed almost simultaneously in 1935 by Henry Eyring , Meredith Gwynne Evans and Michael Polanyi .

  4. Reaction mechanism - Wikipedia

    en.wikipedia.org/wiki/Reaction_mechanism

    In chemistry, a reaction mechanism is the step by step sequence of elementary reactions by which overall chemical reaction occurs. [ 1 ] A chemical mechanism is a theoretical conjecture that tries to describe in detail what takes place at each stage of an overall chemical reaction.

  5. Collision theory - Wikipedia

    en.wikipedia.org/wiki/Collision_theory

    The rate for a bimolecular gas-phase reaction, A + B → product, predicted by collision theory is [6] = = ⁡ ()where: k is the rate constant in units of (number of molecules) −1 ⋅s −1 ⋅m 3.

  6. Lindemann mechanism - Wikipedia

    en.wikipedia.org/wiki/Lindemann_mechanism

    Usually, this mechanism is used in gas phase decomposition and also in isomerization reactions. An example of isomerization by a Lindemann mechanism is the isomerization of cyclopropane. [11] cyclo−C 3 H 6 → CH 3 −CH=CH 2. Although it seems like a simple reaction, it is actually a multistep reaction: cyclo−C 3 H 6 → CH 2 −CH 2 −CH ...

  7. Entropy of activation - Wikipedia

    en.wikipedia.org/wiki/Entropy_of_activation

    while for bimolecular gas reactions A = (e 2 k B T/h) (RT/p) exp(ΔS ‡ /R). In these equations e is the base of natural logarithms, h is the Planck constant, k B is the Boltzmann constant and T the absolute temperature. R′ is the ideal gas constant. The factor is needed because of the pressure dependence of the reaction rate.

  8. Energy profile (chemistry) - Wikipedia

    en.wikipedia.org/wiki/Energy_profile_(chemistry)

    Figure 6:Reaction Coordinate Diagrams showing reactions with 0, 1 and 2 intermediates: The double-headed arrow shows the first, second and third step in each reaction coordinate diagram. In all three of these reactions the first step is the slow step because the activation energy from the reactants to the transition state is the highest.

  9. E1cB-elimination reaction - Wikipedia

    en.wikipedia.org/wiki/E1cB-elimination_reaction

    The E1cB mechanism is just one of three types of elimination reaction. The other two elimination reactions are E1 and E2 reactions. Although the mechanisms are similar, they vary in the timing of the deprotonation of the α-carbon and the loss of the leaving group. E1 stands for unimolecular elimination, and E2 stands for bimolecular elimination.