The molecular structures of pentaborane(11), B5H11, and hexaborane(12), B6H12, in the gas phase as determined by electron diffraction and ab initio calculations
Authors:
- Paul T. BrainPBPaul T. Brain
- Drahomír HnykDrahomír Hnyk
- David W.H. RankinDRDavid W.H. Rankin
- Michael BühlMBMichael Bühl
- Paul von Ragué SchleyerPSPaul von Ragué Schleyer
- 1 May 1994
- journal article
- Published by Elsevier in Polyhedron
- Vol. 13 (9) , 1453-1466
Abstract
No abstract availableKeywords
This publication has 14 references indexed in Scilit:
- Application of the ab initio/IGLO/NMR method to the structure confirmation of the [.mu.5,6-BHNR2-nido-2,4-C2B4H6]- ion intermediate observed during the interaction of closo-2,4-C2B5H7 with LiNR2Inorganic Chemistry, 1993
- Structure and nonrigidity of undecahydrodecaborate(1-). An ab initio/IGLO/NMR studyInorganic Chemistry, 1993
- Molecular structure of 1-thia-closo-dodecaborane(II) studied by electron diffraction complemented by ab initio calculationsInorganic Chemistry, 1992
- Application and evaluation of ab initio chemical shift calculations for boranes and carboranes. How reliable are "accurate" experimental structures?Journal of the American Chemical Society, 1992
- Theoretical refinement of the pentaborane (B5H11) structure. Application of IGLO chemical shift calculationsInorganic Chemistry, 1990
- The molecular structure of hexaborane(12) in the gas phase as determined by electron diffractionJ. Chem. Soc., Dalton Trans., 1988
- The molecular structures of pentaborane(9) and pentaborane(11) in the gas phase as determined by electron diffractionPolyhedron, 1987
- Theory of magnetic susceptibilities and NMR chemical shifts in terms of localized quantities. II. Application to some simple moleculesThe Journal of Chemical Physics, 1982
- The molecular structure of tetraborane(10) in the gas phase as determined by a joint analysis of electron-diffraction and microwave dataJ. Chem. Soc., Dalton Trans., 1981
- Theory of Magnetic Susceptibilities and NMR Chemical Shifts in Terms of Localized QuantitiesIsrael Journal of Chemistry, 1980