Novel rhenium(V) nitride complexes with dithiocarbimate ligands – A synchrotron X-ray and DFT structural investigation

Novel rhenium(V) nitride complexes with dithiocarbimate ligands – A synchrotron X-ray and DFT... We report on the behavior of new sulfonamide based dithiocarbamates towards unusual rhenium(V) precursors featuring the [ReN]2+ core. Reactions proceed by means of a bis-substitution of the ligand, resulting in the formation of a dianionic rhenium(V) complex of the type [ReN(SS)2]2−. The spectroscopic characterization data as well as the crystal structure of the phenyl derivative is reported here for the first time and compared with theoretical calculations. Gas phase DFT investigations involving several different available basis sets were also employed for the first time to treat the electronic configuration of the inorganic cores involving Re(V) nitrides. http://www.deepdyve.com/assets/images/DeepDyve-Logo-lg.png Inorganica Chimica Acta Elsevier

Novel rhenium(V) nitride complexes with dithiocarbimate ligands – A synchrotron X-ray and DFT structural investigation

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Publisher
Elsevier
Copyright
Copyright © 2017 Elsevier B.V.
ISSN
0020-1693
eISSN
1873-3255
D.O.I.
10.1016/j.ica.2017.11.023
Publisher site
See Article on Publisher Site

Abstract

We report on the behavior of new sulfonamide based dithiocarbamates towards unusual rhenium(V) precursors featuring the [ReN]2+ core. Reactions proceed by means of a bis-substitution of the ligand, resulting in the formation of a dianionic rhenium(V) complex of the type [ReN(SS)2]2−. The spectroscopic characterization data as well as the crystal structure of the phenyl derivative is reported here for the first time and compared with theoretical calculations. Gas phase DFT investigations involving several different available basis sets were also employed for the first time to treat the electronic configuration of the inorganic cores involving Re(V) nitrides.

Journal

Inorganica Chimica ActaElsevier

Published: Apr 24, 2018

References

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