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In chemistry, initiation is a chemical reaction that triggers one or more secondary reactions. Initiation creates a reactive centre on a molecule which produces a chain reaction . [ 1 ] The reactive centre generated by initiation is usually a radical , but can also be cations or anions . [ 2 ]
In 2020, it was announced that Google's AlphaFold, a neural network based on DeepMind artificial intelligence, is capable of predicting a protein's final shape based solely on its amino-acid chain with an accuracy of around 90% on a test sample of proteins used by the team.
In the simplest example oxygen can be used as it exists naturally in its triplet state (i.e. it is a diradical). This is referred to as air inhibition and is a diffusion-controlled reaction with rates typically in the order of 10 7 –10 9 mol −1 s −1 , [ 3 ] the resulting peroxy radicals (ROO•) are less reactive towards polymerisation.
For example, di-tert-butyl peroxide (t-Bu OOt-Bu) gives two t-butoxy radicals (t-BuO•) and the radicals become methyl radicals (CH 3 •) with the loss of acetone. Benzoyl peroxide (( Ph C)OO) 2 ) generates benzoyloxyl radicals (PhCOO•), each of which loses carbon dioxide to be converted into a phenyl radical (Ph•).
Chemical reactions involving thermal runaway are also called thermal explosions in chemical engineering, or runaway reactions in organic chemistry.It is a process by which an exothermic reaction goes out of control: the reaction rate increases due to an increase in temperature, causing a further increase in temperature and hence a further rapid increase in the reaction rate.
High energy initiation refers to the generation of chain carriers by radiation. Chemical initiation is due to a chemical initiator. For the case of radical polymerization as an example, chain initiation involves the dissociation of a radical initiator molecule (I) which is easily dissociated by heat or light into two free radicals (2 R°).
In organosulfur chemistry, the thiol-ene reaction (also alkene hydrothiolation) is an organic reaction between a thiol (R−SH) and an alkene (R 2 C=CR 2) to form a thioether (R−S−R'). This reaction was first reported in 1905, [ 1 ] but it gained prominence in the late 1990s and early 2000s for its feasibility and wide range of applications.
These initiation steps generate macroradicals at tertiary sites, as these are more stabilised. The propagation steps are essentially identical to those seen for polyolefins; with oxidation, hydrogen abstraction and photolysis leading to beta scission reactions and increasing numbers of radicals.