Computational study of H-abstraction reactions from CH3OCH2CH2Cl/CH3CH2OCH2CH2Cl by Cl atom and OH radical and fate of alkoxy radicals

Alecu IM(2010)Computational thermochemistry: scale factor databases and scale factors for vibrational frequencies obtained from electronic model chemistries J Chem Theory Comput 6 2872-2887

Zheng J(2003)Atmospheric degradation of volatile organic compounds Chem Rev 103 4605-4463

Zhao Y(1993)A new mixing of Hartree-Fock and local density-functional theories J Chem Phys 98 1372-1377

Truhlar DG(2015)Theoretical insight on atmospheric chemistry of HFE-365mcf3: reactions with OH radicals, atmospheric lifetime, and fate of alkoxy radicals (CF J Mol Model 21 69-6447

Atkinson R(2007)CF J Geophys Res Atmos 112 D15108-497

Arey J(2012)CH(O•)OCH Chem Soc Rev 41 6405-1149

Becke AD(2009)/CF In J Chem Kinet 41 490-12

Bhattacharjee D(1999)CF J Phys Chem A 103 1140-13103

Mishra BK(1997)CH J Fluor Chem 82 9-426

Deka RC(2010)OCH J Phys Chem A 114 13093-396

Alecu IM(2010)Computational thermochemistry: scale factor databases and scale factors for vibrational frequencies obtained from electronic model chemistries J Chem Theory Comput 6 2872-2887

Zheng J(2003)Atmospheric degradation of volatile organic compounds Chem Rev 103 4605-4463

Zhao Y(1993)A new mixing of Hartree-Fock and local density-functional theories J Chem Phys 98 1372-1377

Truhlar DG(2015)Theoretical insight on atmospheric chemistry of HFE-365mcf3: reactions with OH radicals, atmospheric lifetime, and fate of alkoxy radicals (CF J Mol Model 21 69-6447

Atkinson R(2007)CF J Geophys Res Atmos 112 D15108-497

Arey J(2012)CH(O•)OCH Chem Soc Rev 41 6405-1149

Becke AD(2009)/CF In J Chem Kinet 41 490-12

Bhattacharjee D(1999)CF J Phys Chem A 103 1140-13103

Mishra BK(1997)CH J Fluor Chem 82 9-426

Deka RC(2010)OCH J Phys Chem A 114 13093-396