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- W2134482617 abstract "Abstract Ab initio calculations on three 1,3,2-diazaphosphole derivatives [(MP2/6-31G(d,p)] gave rise to structural and energetic data that are interpreted in context of aromaticity. The 1,3,2-diazaphospholenium ion is shown to have a degree of aromatic stabilization energy (24.0 kcal/mol) comparable to that of pyrrole. Cyclic delocalization is supported by analysis of computed charge distribution data, natural bond orbital data, bond lengths, and magnetic susceptibility data." @default.
- W2134482617 created "2016-06-24" @default.
- W2134482617 creator A5072087282 @default.
- W2134482617 date "2010-08-03" @default.
- W2134482617 modified "2023-09-26" @default.
- W2134482617 title "ChemInform Abstract: Ab initio Calculations on 1,3,2-Diazaphospholes: New Heteroaromatic Systems." @default.
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- W2134482617 doi "https://doi.org/10.1002/chin.199722028" @default.
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