Synthesis and Characterization of a Copper Dinitrogen Complex Supported by a Weakly Coordinating Anion

We report the synthesis and full characterization of the copper dinitrogen complex [(η1-N2)CuAl(ORF)4] 2 (RF=C(CF3)3) prepared by a cascade metathesis reaction of Ag[Al(ORF)4] with CuI-excess in iso-perfluorohexane (i-pfh) under N2 atmosphere. Title compound 2 features an extraordinarily high N2 str...

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Main Authors: Willrett, Julie (Author) , Schmitt, Manuel (Author) , Zhuravlev, Vadim (Author) , Sellin, Malte (Author) , Malinowski, Przemysław J. (Author) , Krossing, Ingo (Author)
Format: Article (Journal)
Language:English
Published: Sep 2024
In: Angewandte Chemie. International edition
Year: 2024, Volume: 63, Issue: 38, Pages: 1-7
ISSN:1521-3773
DOI:10.1002/anie.202405330
Online Access:Verlag, kostenfrei, Volltext: https://doi.org/10.1002/anie.202405330
Verlag, kostenfrei, Volltext: https://onlinelibrary.wiley.com/doi/abs/10.1002/anie.202405330
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Author Notes:Julie Willrett, Manuel Schmitt, Vadim Zhuravlev, Malte Sellin, Przemysław J. Malinowski, Ingo Krossing

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520 |a We report the synthesis and full characterization of the copper dinitrogen complex [(η1-N2)CuAl(ORF)4] 2 (RF=C(CF3)3) prepared by a cascade metathesis reaction of Ag[Al(ORF)4] with CuI-excess in iso-perfluorohexane (i-pfh) under N2 atmosphere. Title compound 2 features an extraordinarily high N2 stretching frequency at 2313/2314 cm−1 (IR/Raman) and was characterized by single-crystal and powder X-ray diffractometry. Quantum chemical charge displacement analysis based on natural orbitals of chemical valence (CD-NOCV) indicates that the copper-dinitrogen interaction is still governed by weak π-backdonation, but is significantly reduced compared to all literature-known transition metal dinitrogen complexes. 
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