Kinetic studies of the gas phase reaction of 1,2-propylene oxide with the OH radical over a temperature range of 261–335 K

Autor: Sumana SenGupta, Awadhesh Kumar, Asmita Sharma, Anmol Virmani, Ankur Saha, Mohini P. Walavalkar
Rok vydání: 2020
Předmět:
Zdroj: Atmospheric Environment. 237:117709
ISSN: 1352-2310
DOI: 10.1016/j.atmosenv.2020.117709
Popis: The rate coefficient for the gas phase reaction of the OH radical with 1,2-propylene oxide (PPO) has been measured at 298 K using a relative rate method, employing Gas Chromatography (GC) technique, using ethane and 1,2-dichloroethane as reference compounds. Temperature dependence of the above reaction is also studied using an absolute rate method, employing Laser Photolysis-Laser Induced Fluorescence (LP-LIF) technique, over a range of 261–335 K. The measured bimolecular rate coefficients were fitted into the Arrhenius plot, which yielded a straight line roughly parallel to the x-axis and implies no or very weak temperature dependence. Within the experimental error limits, rate coefficients obtained at various temperatures, are found to vary within a narrow range from (4.65 ± 0.24) × 10−13 to (4.80 ± 0.24) × 10−13 cm3 molecule−1 s−1. Room temperature rate coefficient of the reaction of PPO with the OH radical was found to be (4.65 ± 0.24) × 10−13 cm3 molecule−1 s−1, using LP-LIF technique. These results have been discussed with available literature to unveil the probable mechanism. An average tropospheric lifetime of PPO has been estimated to be about two weeks for degradation by the OH radical. In addition, atmospheric parameters such as Radiative Efficiency (RE) and Global Warming Potential (GWP) for PPO are determined. Stable products formed are characterized using GC-MS and FT-IR techniques. Theoretical calculations are performed to understand the energetics and mechanism of H atom abstraction by OH, and also to complement the experimental observations.
Databáze: OpenAIRE
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