Composition of overheated vapors and molecular structure of monomeric tris-hexafluoroacetylacetonates of lanthanum, neodymium and samarium

► Structure and vapor composition of Ln(hfa) 3(Ln=La,Nd,Sm) determined by gas electron diffraction and mass-spectrometry. ► Vapors are highly oligomerized. ► Monomeric molecules have D 3-symmetry. ► Lanthanide contraction in the Ln(hfa)3 series is 0.198(18) Å. Molecular structure of lanthanum, neody...

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Veröffentlicht in:Journal of molecular structure 2011-12, Vol.1006 (1), p.173-179
Hauptverfasser: Rybkin, V.V., Tverdova, N.V., Girichev, G.V., Shlykov, S.A., Kuzmina, N.P., Zaitseva, I.G.
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container_end_page 179
container_issue 1
container_start_page 173
container_title Journal of molecular structure
container_volume 1006
creator Rybkin, V.V.
Tverdova, N.V.
Girichev, G.V.
Shlykov, S.A.
Kuzmina, N.P.
Zaitseva, I.G.
description ► Structure and vapor composition of Ln(hfa) 3(Ln=La,Nd,Sm) determined by gas electron diffraction and mass-spectrometry. ► Vapors are highly oligomerized. ► Monomeric molecules have D 3-symmetry. ► Lanthanide contraction in the Ln(hfa)3 series is 0.198(18) Å. Molecular structure of lanthanum, neodymium and samarium tris-hexafluoroacetylacetonates has been studied by means of simultaneous gas electron diffraction and mass-spectrometric experiment and quantum-chemical calculations. The coordination polyhedron LnO 6 was confirmed to be a distorted antiprism of D 3-symmetry, and the experimental lanthanide contraction for hfa-complexes within La–Lu series was found to be 0.198(18) Å. Molecular species of La(hfa) 3, Nd(hfa) 3 and Sm(hfa) 3 present in vapor at various degrees of overheating have been identified.
doi_str_mv 10.1016/j.molstruc.2011.09.003
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subjects chemical structure
Distortion
Gas electron diffraction
Lanthanides
lanthanum
Molecular structure
neodymium
samarium
Tris-hexaflouroacetylacetonates
Vapor composition
vapors
title Composition of overheated vapors and molecular structure of monomeric tris-hexafluoroacetylacetonates of lanthanum, neodymium and samarium
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