Angewandte Chemie International Edition in English · 1994 · 20 citations · 7 references
Natural SciencesChemistryComputational ChemistryInorganic ChemistryPhysical ChemistryAb Initio MethodsCluster ChemistryCoordination ChemistryCrystal ChemistryCrystallographyMolecular Orbital TheoryAb Initio CalculationsAb Initio Molecular CalculationsAb Initio Potential Energy SurfacesBonding GeometryCoordination PolyhedraOctahedral ComplexesOctahedral CoordinationTetrahedral Coordination
The H atoms and not the Si atom of the SiH3 groups coordinate to two of the eight Na atoms in [Na8(OC2H4OC2H4OCH3)6-(SiH3)2]. Shown here is the novel Na8O6 polyhedron containing the two SiH3 groups. The surfaces of the Na8 cube are capped by oxygen atoms. Ab initio calculations on a suitable model showed that the inverted coordination mode is indeed energetically more favorable.
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Brian T. Luke, J. A. Pople, Mary-Beth Krogh-Jespersen et al. · Journal of the American Chemical Society · 1986 · 166 citations
Thomas Steinke, Paul von Ragué Schleyer, Roland Boese · Angewandte Chemie International Edition in English · 1991 · 95 citations
Natural Sciences, Chemistry, Physics +14
CRYSTAL STRUCTURE OF POTASSIUM SILYL
M. A. Ring, D. M. Ritter · The Journal of Physical Chemistry · 1961 · 28 citations