Email this article Induced currents and an 1H NMR chemical shifts in transition metal clusters (μ-H)2Fe3(μ3-Q)(CO)9 (Q = S, Se, Te)
- Authors: Ryzhikov M.R.1,2, Kozlova S.G.1,2
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Affiliations:
- Nikolaev Institute of Inorganic Chemistry, Siberian Branch
- Novosibirsk National Research State University
- Issue: Vol 58, No 5 (2017)
- Pages: 861-865
- Section: Article
- URL: https://journals.rcsi.science/0022-4766/article/view/161475
- DOI: https://doi.org/10.1134/S002247661705002X
- ID: 161475
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Abstract
The quantum chemical calculations of induced electric currents in (μ-H)2Fe3(μ3-Q)(CO)9 complexes, where Q = S, Se, Te, are carried out. It is demonstrated that the appearance of anomalous 1Н NMR chemical shifts on bridging hydrogen atoms is, first of all, due to the effect of induced currents on iron atoms.
About the authors
M. R. Ryzhikov
Nikolaev Institute of Inorganic Chemistry, Siberian Branch; Novosibirsk National Research State University
Email: sgk@niic.nsc.ru
Russian Federation, Novosibirsk; Novosibirsk
S. G. Kozlova
Nikolaev Institute of Inorganic Chemistry, Siberian Branch; Novosibirsk National Research State University
Author for correspondence.
Email: sgk@niic.nsc.ru
Russian Federation, Novosibirsk; Novosibirsk
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