Atmospheric chemistry of CF3CN: kinetics and products of reaction with OH radicals, Cl atoms and O3
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Atmospheric chemistry of CF3CN : kinetics and products of reaction with OH radicals, Cl atoms and O3. / Andersen, Mads Peter Sulbaek; Ohide, Joanna; Sølling, Theis I.; Nielsen, Ole John.
In: Physical Chemistry Chemical Physics, Vol. 24, No. 4, 2022, p. 2638–2645.Research output: Contribution to journal › Journal article › Research › peer-review
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TY - JOUR
T1 - Atmospheric chemistry of CF3CN
T2 - kinetics and products of reaction with OH radicals, Cl atoms and O3
AU - Andersen, Mads Peter Sulbaek
AU - Ohide, Joanna
AU - Sølling, Theis I.
AU - Nielsen, Ole John
N1 - Correction: https://doi.org/10.1039/D3CP90084C
PY - 2022
Y1 - 2022
N2 - Long path length FTIR-smog chamber techniques were used to study the title reactions in 700 Torr of N2, oxygen or air diluent at 296 ± 2 K. Values of k(Cl + CF3CN) = (2.43 ± 0.33) × 10−15 and k(OH + CF3CN) = (4.61 ± 0.34) × 10−15 cm3 molecule−1 s−1 were measured. There was no discernible reaction of CF3CN with O3 and an upper limit of k(O3 + CF3CN) ≤ 7.9 × 10−24 cm3 molecule−1 s−1 was established. The IR spectra of CF3CN and CF3CF2CN are reported. The atmospheric lifetime of CF3CN is determined by the reaction with OH and is approximately 6.9 years. Reaction of CF3CN with Cl atoms in a chamber study gives (Z-) and/or (E-) CF3CCl[double bond, length as m-dash]NCl and CF3C(O)Cl as major primary products. Under environmental conditions, the OH radical initiated oxidation gives COF2 in a yield of (96 ± 8)%. The global warming potential for CF3CN is estimated as 1030 for a 100 year time horizon.
AB - Long path length FTIR-smog chamber techniques were used to study the title reactions in 700 Torr of N2, oxygen or air diluent at 296 ± 2 K. Values of k(Cl + CF3CN) = (2.43 ± 0.33) × 10−15 and k(OH + CF3CN) = (4.61 ± 0.34) × 10−15 cm3 molecule−1 s−1 were measured. There was no discernible reaction of CF3CN with O3 and an upper limit of k(O3 + CF3CN) ≤ 7.9 × 10−24 cm3 molecule−1 s−1 was established. The IR spectra of CF3CN and CF3CF2CN are reported. The atmospheric lifetime of CF3CN is determined by the reaction with OH and is approximately 6.9 years. Reaction of CF3CN with Cl atoms in a chamber study gives (Z-) and/or (E-) CF3CCl[double bond, length as m-dash]NCl and CF3C(O)Cl as major primary products. Under environmental conditions, the OH radical initiated oxidation gives COF2 in a yield of (96 ± 8)%. The global warming potential for CF3CN is estimated as 1030 for a 100 year time horizon.
U2 - 10.1039/D1CP05288H
DO - 10.1039/D1CP05288H
M3 - Journal article
VL - 24
SP - 2638
EP - 2645
JO - Physical Chemistry Chemical Physics
JF - Physical Chemistry Chemical Physics
SN - 1463-9076
IS - 4
ER -
ID: 289527949