A structure–activity relationship (SAR) for predicting rate constants for the reaction of NO3, OH and O3 with monoalkenes and conjugated dienes
Literature Information
A simple method of predicting rate constants for the reaction between NO3, OH or O3 and substituted alkenes (monoalkenes and conjugated dienes) has been demonstrated using a simple structure–activity relationship (SAR) based on the structure of the alkene. The SAR is useful in providing an initial estimate of an unknown rate constant for a reaction of an alkene and the important tropospheric oxidants NO3, OH or O3.
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Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.










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