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- W1998043093 abstract "The electronic emission and absorption spectra of various oxamides for which the dihedral angles vary from 0° to 180° have been studied experimentally and computationally. The interpretation of the computational data proceeds along a composite-molecule point of view in which the electronic states of oxamide are related to those of component amides. By this means, we have identified the lower-energy excited singlet states of various trans-planar, cis-planar, and twisted oxamides and have determined their dependence on the dihedral angle between the two carbonyl groups. The phosphorescence characteristics of the oxamides are not unambiguously interpretable. Nonetheless, if oxamide be viewed as a member of the large set of isoelectronic α-dicarbonyls and if our singlet state assignments be accepted, we find it possible to rationalize the phosphorescence characteristics of oxamides in terms of vibronic mixing of 3Γnπ∗ and 3Γππ∗ state." @default.
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- W1998043093 date "1973-09-01" @default.
- W1998043093 modified "2023-10-17" @default.
- W1998043093 title "The electronic spectroscopy of oxamides" @default.
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- W1998043093 doi "https://doi.org/10.1016/0022-2852(73)90095-7" @default.
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