The pitfalls of using JHF spin–spin coupling constants to infer hydrogen bond formation in organofluorine compounds

Theoretical decomposition of “through space” spin–spin coupling constants (SSCCs) in organofluorine compounds signal that intramolecular hydrogen bonds (H-bonds) are not the primary mechanism of transmission for SSCCs. Increasing solvent polarity may disrupt H-bonds, but not necessarily the JFH SSCC...

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Veröffentlicht in:	Chemical communications (Cambridge, England) England), 2023-12, Vol.59 (99), p.14661-14664
Hauptverfasser:	Cariello, Guilherme, Zeoly, Lucas A, Piscelli, Bruno A, Lectka, Thomas, Cormanich, Rodrigo A
Format:	Artikel
Sprache:	eng
Schlagworte:	Chemical bonds Hydrogen bonds Organofluorine compounds Spin-spin coupling
Online-Zugang:	Volltext
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