## Abstract The results of __ab initio__ “supermolecule” calculations of the charge transfer between formamide and the enol forms of methylglyoxal, ethylglyoxal, dimethylglyoxal, and propenylglyoxal are compared for several different conformations of the constituent molecules. The enols were found
Quantum chemical investigations of charge transfer interactions in relation to the electronic theory of cancer: Part III. The interaction of formamide and various glyoxals
✍ Scribed by John R. Ball; Colin Thomson
- Book ID
- 119116197
- Publisher
- Elsevier Science
- Year
- 1984
- Tongue
- English
- Weight
- 941 KB
- Volume
- 109
- Category
- Article
- ISSN
- 0166-1280
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## Abstract The results of __ab initio__ “supermolecule” calculations of the charge transfer between formamide and methylglyoxal, ethylglyoxal, and dimethylglyoxal are compared for several different relative conformations of the constituent molecules. The charge transfer properties of ethylglyoxal
The enthalpies of formation for charge transfer complexes of the type [R&1.1,] (R = CH3, C2F5, n-C3H,, n-&H,) have been measured by calorimetry. The data are analysed using Mulliken's resonance structure theory, to produce the different energy contributions to the formation ofand the charge transfer