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PubMed · 17020247

Metastable intermolecular charge-transfer complexes with a pentavalent carbon atom.

Fedor Y Naumkin
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Abstract

A novel type of metastable complexes of metal (such as Na) atoms with a super-fluorinated carbon molecule is investigated, with a carbon atom exhibiting a unique, pentavalent character. It is induced by the charge transfer from the alkali metal component, followed by a geometric compression of the ion pair system. Analysis of the electron-density distribution confirms the real chemical nature of the extra C-F bond. Structure and stability of the system are characterized ab initio, and a spectrum of electronic perturbations is considered. The ways of forming the systems are discussed, and the spectroscopic parameters are predicted, facilitating their detection in experiments.

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CarbonElectronsIsomerismModels, MolecularMolecular ConformationJournal Article

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Fedor Y Naumkin. 2006-10-12. Metastable intermolecular charge-transfer complexes with a pentavalent carbon atom.. https://doi.org/10.1021/jp064525a

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