Related references
Note: Only part of the references are listed.
Article
Chemistry, Physical
Theoretical study of the NO3 radical reaction with CH2ClBr, CH2ICl, CH2BrI, CHCl2Br, and CHClBr2
Ibon Alkorta et al.
Summary: This study theoretically investigates the reaction of the main nighttime atmospheric oxidant, the nitrate radical (NO3), with five alkyl halides. It finds that the most favorable reaction is hydrogen atom transfer. The reactions are classified into two groups based on the number of hydrogen atoms in the halon molecules. The results indicate that the chemical lifetime of the alkyl halides would not be substantially affected by nitrate radical reactions, even in NO3-polluted atmospheric conditions.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2022)
Review
Chemistry, Physical
Exploring the Limit of Accuracy of the Global Hybrid Meta Density Functional for Main-Group Thermochemistry, Kinetics, and Noncovalent Interactions
Yan Zhao et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2008)
Article
Chemistry, Physical
A detailed study on the symmetry breaking and its effect on the potential surface of NO3
W Eisfeld et al.
JOURNAL OF CHEMICAL PHYSICS (2000)