Emergence of the structure-directing role of f-orbital overlap-driven covalency

In actinide chemistry, a longstanding bonding model describes metal-ligand binding using 6d-orbitals, with the 5f-orbitals remaining non-bonding. Here the authors explore the inverse-trans-influence — a case where the model breaks down — finding that the f-orbitals play a crucial role in dictating a...

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Main Authors: Erli Lu, Saira Sajjad, Victoria E. J. Berryman, Ashley J. Wooles, Nikolas Kaltsoyannis, Stephen T. Liddle
Format: Article
Language:English
Published: Nature Portfolio 2019-02-01
Series:Nature Communications
Online Access:https://doi.org/10.1038/s41467-019-08553-y
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author Erli Lu
Saira Sajjad
Victoria E. J. Berryman
Ashley J. Wooles
Nikolas Kaltsoyannis
Stephen T. Liddle
author_facet Erli Lu
Saira Sajjad
Victoria E. J. Berryman
Ashley J. Wooles
Nikolas Kaltsoyannis
Stephen T. Liddle
author_sort Erli Lu
collection DOAJ
description In actinide chemistry, a longstanding bonding model describes metal-ligand binding using 6d-orbitals, with the 5f-orbitals remaining non-bonding. Here the authors explore the inverse-trans-influence — a case where the model breaks down — finding that the f-orbitals play a crucial role in dictating a trans-ligand-directed geometry.
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spelling doaj.art-67caa517e6ee41fea7114dc4bd0165402022-12-21T18:03:58ZengNature PortfolioNature Communications2041-17232019-02-0110111010.1038/s41467-019-08553-yEmergence of the structure-directing role of f-orbital overlap-driven covalencyErli Lu0Saira Sajjad1Victoria E. J. Berryman2Ashley J. Wooles3Nikolas Kaltsoyannis4Stephen T. Liddle5School of Chemistry, The University of ManchesterSchool of Chemistry, The University of ManchesterSchool of Chemistry, The University of ManchesterSchool of Chemistry, The University of ManchesterSchool of Chemistry, The University of ManchesterSchool of Chemistry, The University of ManchesterIn actinide chemistry, a longstanding bonding model describes metal-ligand binding using 6d-orbitals, with the 5f-orbitals remaining non-bonding. Here the authors explore the inverse-trans-influence — a case where the model breaks down — finding that the f-orbitals play a crucial role in dictating a trans-ligand-directed geometry.https://doi.org/10.1038/s41467-019-08553-y
spellingShingle Erli Lu
Saira Sajjad
Victoria E. J. Berryman
Ashley J. Wooles
Nikolas Kaltsoyannis
Stephen T. Liddle
Emergence of the structure-directing role of f-orbital overlap-driven covalency
Nature Communications
title Emergence of the structure-directing role of f-orbital overlap-driven covalency
title_full Emergence of the structure-directing role of f-orbital overlap-driven covalency
title_fullStr Emergence of the structure-directing role of f-orbital overlap-driven covalency
title_full_unstemmed Emergence of the structure-directing role of f-orbital overlap-driven covalency
title_short Emergence of the structure-directing role of f-orbital overlap-driven covalency
title_sort emergence of the structure directing role of f orbital overlap driven covalency
url https://doi.org/10.1038/s41467-019-08553-y
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AT ashleyjwooles emergenceofthestructuredirectingroleofforbitaloverlapdrivencovalency
AT nikolaskaltsoyannis emergenceofthestructuredirectingroleofforbitaloverlapdrivencovalency
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