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Issue 12, 2016
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A combined quantum-chemical and matrix-isolation study on molecular manganese fluorides

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Abstract

Molecular manganese fluorides were studied using quantum-chemical calculations at DFT and CCSD(T) levels and experimentally by matrix-isolation techniques. They were prepared by co-deposition of IR-laser ablated elemental manganese or manganese trifluoride with F2 in an excess of Ne, Ar, or N2 or with neat F2 at 5–12 K. New IR bands in the Mn–F stretching region are detected and assigned to matrix-isolated molecular MnFx (x = 1–3).

Graphical abstract: A combined quantum-chemical and matrix-isolation study on molecular manganese fluorides

  • This article is part of the themed collection: Fluorine
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Publication details

The article was received on 10 Dec 2015, accepted on 18 Jan 2016 and first published on 19 Jan 2016


Article type: Paper
DOI: 10.1039/C5DT04827C
Citation: Dalton Trans., 2016,45, 5038-5044
  • Open access: Creative Commons BY license
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    A combined quantum-chemical and matrix-isolation study on molecular manganese fluorides

    F. Brosi, T. Schlöder, A. Schmidt, H. Beckers and S. Riedel, Dalton Trans., 2016, 45, 5038
    DOI: 10.1039/C5DT04827C

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