The Halogen Bond in Weakly Bonded Complexes and the Consequences for Aromaticity and Spin-Orbit Coupling

The Halogen Bond in Weakly Bonded Complexes and the Consequences for Aromaticity and Spin-Orbit Coupling

The halogen bond complexes CF<inline-formula><math xmlns="http://www.w3.org/1998/Math/MathML" display="inline"><semantics><msub><mrow></mrow><mn>3</mn></msub></semantics></math></inline-formula>X⋯Y and C<i...

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Bibliographic Details
Main Authors: Ana V. Cunha, Remco W. A. Havenith, Jari van Gog, Freija De Vleeschouwer, Frank De Proft, Wouter Herrebout
Format: Article
Language:English
Published: MDPI AG 2023-01-01
Series:Molecules
Subjects:
halogen bonds
density functional theory
energy decomposition analysis
ring current analysis
spin-orbit coupling
Online Access:https://www.mdpi.com/1420-3049/28/2/772

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https://www.mdpi.com/1420-3049/28/2/772

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