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• W2078595132 abstract "The model structure dioxetanone is the common feature among several chemiluminescent species, including luciferin. By MINDO/3 SCF calculations, with limited Cl, it is established that the dissociation pathway maintains planarity and that there is little diradical character to the transition state. We see no evidence for the easy population of excited states of products from this transition state, implying that the luminescence may involve charge transfer from substituents." @default.
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• W2078595132 date "1983-10-01" @default.
• W2078595132 modified "2023-09-26" @default.
• W2078595132 title "A MINDO/3 study of the properties of the ground state dioxetanone molecule and its dissociation potential energy surgace into (CH2O + CO2)" @default.
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• W2078595132 doi "https://doi.org/10.1016/0166-1280(83)80196-1" @default.
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