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OH radical reaction rate constants for polycyclic alkanes: Effects of ring strain and consequences for estimation methods

✍ Scribed by Roger Atkinson; Sara M. Aschmann

Publisher: John Wiley and Sons
Year: 1992
Tongue: English
Weight: 364 KB
Volume: 24
Category: Article
ISSN: 0538-8066
DOI: 10.1002/kin.550241108

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✦ Synopsis

Abstract

Using a relative rate method, rate constants for the gas‐phase reactions of the OH radical with trans‐pinane [(1R, 2R)‐2, 6, 6‐trimethylbicyclo[3.1.1]heptane], tricyclene (1, 7, 7‐trimethyltricyclo[2.2.1.0^2, 6^]heptane), and quadricyclane (quadricyclo[2.2.1.0^2, 6^.0^3, 5^]heptane) of (1.34 ± 0.29) × 10^−11^ cm^3^ molecule^−1^ s^−1^, (2.86 ± 0.62) × 10^−12^ cm^3^ molecule^−1^ s^−1^ and (1.83 ± 0.41) × 10^−12^ cm^3^ molecule^−1^ s^−1^, respectively, have been determined at 296 ± 2 K. These rate constants are compared with values calculated from an empirical estimation method and used to refine this estimation technique for the calculation of OH radical reaction rate constants for polycyclic systems. © John Wiley & Sons, Inc.

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