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Experimental and theoretical conformation analysis of eight-membered silocines with planar fragments
Authors
Chachkov D.
Gazizova A.
+4 more
Ishmaeva E.
Timosheva A.
Timosheva N.
Vereshchagina Y.
Publication date
1 January 2010
Publisher
Abstract
The dipole moments of 6-thia-4,5: 6,7-dibenzo-1,3,2-dioxasilocines were determined experimentally and calculated at the DFT B3LYP/6-31G*level of theory and by the additivity scheme. The experimental and theoretical (DFT B3LYP/6-31G*) conformation analysis of eight-membered 1,3,2-dioxasilocines having planar fragments showed that these compounds in solution exist as boat-chair, boat-boat, or twist-boat conformers, depending on the presence of unsaturated planar fragment, nature of the heteroatom in position 6 of the eight-membered ring, and substituents on the silicon atom. © 2010 Pleiades Publishing, Ltd
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Kazan Federal University Digital Repository
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oai:dspace.kpfu.ru:net/102580
Last time updated on 07/05/2019
Kazan Federal University Digital Repository
See this paper in CORE
Go to the repository landing page
Download from data provider
oai:dspace.kpfu.ru:net/138643
Last time updated on 07/05/2019