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- W2095294530 abstract "Isomeric charge-transfer chromophores using 1,2,3-triazol-diyl as linker have been studied experimentally and computationally. The instability of the polarized reactants precluded the use of the Huisgen reaction and alternative synthetic methodologies were employed. Charge-transfer absorptions between an N,N-dimethylanilino and a dicyanovinyl group are modest to strong, with maxima from λmax = 400 to 453 nm depending on substituent positioning. TD-B3LYP/6-31G(d) calculations are within 0.6 eV of experiment and assign these bands as HOMO−LUMO transitions." @default.
- W2095294530 created "2016-06-24" @default.
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- W2095294530 date "2008-06-27" @default.
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- W2095294530 title "1,2,3-Triazoles as Conjugative π-Linkers in Push−Pull Chromophores: Importance of Substituent Positioning on Intramolecular Charge-Transfer" @default.
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- W2095294530 doi "https://doi.org/10.1021/ol801253z" @default.
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