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- W2089359401 abstract "The decomposition reaction of dimethyl-1,2-dioxetanone in dichloromethane was studied by using a DFT approach. The low efficiency of triplet and singlet excited-state formation was rationalised. A charge-transfer process was demonstrated to be involved in the chemiluminescence process. Present and previous results allow us to define an interstate crossing-induced chemiexcitation (ICIC) mechanism for the chemiluminescence of dioxetanones. Charge transfer is needed to reach a transition state, in the vicinity of which direct population of excited states is possible. The chemiexcitation process is then governed by singlet/triplet intersystem crossings. Structural modifications then modify the rate of these crossings and the singlet ground and excited-state interaction, thereby modulating the efficiency of this process and the spin of the resulting products." @default.
- W2089359401 created "2016-06-24" @default.
- W2089359401 creator A5026513060 @default.
- W2089359401 creator A5047405657 @default.
- W2089359401 date "2013-02-05" @default.
- W2089359401 modified "2023-10-10" @default.
- W2089359401 title "Interstate Crossing-Induced Chemiexcitation as the Reason for the Chemiluminescence of Dioxetanones" @default.
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- W2089359401 doi "https://doi.org/10.1002/cphc.201200872" @default.
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