Angewandte Chemie International Edition · 2003 · 98 citations · 22 references
Natural SciencesChemistryMaterials ScienceFunctional MaterialsInorganic ChemistryOrganic ChemistryCrystal ChemistryLanthanide Chemistry
Highly explosive Te(N3)4 was prepared by the fluoride-ion-catalyzed reaction of TeF6 and Me3SiN3, and converted to the more stable [P(C6H5)4]2[Te(N3)6] salt by reaction with [P(C6H5)4]N3. The sterically active free valence-electron pair at the Te center strongly distorts the structure of the [Te(N3)6]2− ion from the predicted ideal S6 symmetry (see picture). Evidence for the formation of the [Te(N3)5]− ion is also presented.
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Density-functional thermochemistry. III. The role of exact exchange
Axel D. Becke · The Journal of Chemical Physics · 1993 · 102.8K citations
Natural Sciences, Chemistry, Physics +13
General atomic and molecular electronic structure system
Michael W. Schmidt, Kim K. Baldridge, Jerry A. Boatz et al. · Journal of Computational Chemistry · 1993 · 20.2K citations
Natural Sciences, Chemistry, Physics +17