Article ID Journal Published Year Pages File Type
1328556 Journal of Organometallic Chemistry 2006 13 Pages PDF
Abstract
Thermodynamic and structural data for 24 singlet (s) and triplet (t) states of X-CPSi halophosphasilylenes, confined to the three structures, are studied at eight ab initio and DFT levels and compared with their haloazasilylene analogues.
Keywords
Related Topics
Physical Sciences and Engineering Chemistry Inorganic Chemistry
Preview
From halo-azasilylenes to halo-phosphasilylenes (X-CNSi vs. X-CPSi) at ab initio and DFT levels
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