Kinetics and mechanism of the reaction of Cl atoms with nitrobenzene

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Smog chamber/FTIR techniques were used to study the kinetics and mechanism of the reaction of Cl atoms with nitrobenzene (C6H5NO2) in 10-700 Torr of N2, or air, at 296 K. The reaction proceeds with a rate constant k(Cl + C6H5NO2) = (9.3 ± 1.9) × 10-13 cm3 molecule-1 s-1 to give C6H5Cl and NO2 products in essentially 100% yield. The observed product yields suggest that the reaction proceeds via a displacement mechanism (probably addition followed by elimination). The UV-visible absorption spectrum of C6H5NO2 was measured. Photolysis of C6H5NO2 is estimated to occur at a rate of (3 ± 2) × 10-5 s-1 for a solar zenith angle of 25° (representative of a typical summer day at 40°N) and is likely to be the dominant atmospheric loss mechanism for C6H5NO2.

OriginalsprogEngelsk
TidsskriftJournal of Physical Chemistry A
Vol/bind104
Udgave nummer48
Sider (fra-til)11328-11331
Antal sider4
ISSN1089-5639
DOI
StatusUdgivet - 7 dec. 2000

ID: 223681038