Computational Modelling of the Mechanisms, Kinetics and Thermodynamics of Pyrolysis of Isobutyl Bromide in the Gas-phase
Olubunmi Omolara Adeboye · Chemical Science International Journal · 2017
The kinetics, mechanisms and thermodynamics of the gas-phase pyrolysis of isobutyl bromide at 623 K was carried out using Density Functional Theory modelling with B3LYP at 6-311++G (2df, 2 p) level method of calculation. Calculations showed that the reaction is a unimolecular rea...
Open access
Research Article
10.9734/CSJI/2017/30922