Halogen bonding promotes ferromagnetic exchange in nitronyl nitroxide radicals: A quantitative analysis; Materials Chemistry and Physics; Vol. 332

Bibliografiske detaljer
Parent link:Materials Chemistry and Physics.— .— Amsterdam: Elsevier Science Publishing Company Inc.
Vol. 332.— 2025.— Article number 130252, 9 p.
Andre forfattere: Kudryavtseva E. N. Ekaterina, Tretyakov E. V. Evgeny, Gomila R. M. Rosa, Frontera A. Antonio, Dmitriev A. А. Alexey, Gritsan N. P. Nina, Debin Xia, Efimov N. N. Nikolay, Petunin P. V. Pavel Vasilievich, Postnikov P. S. Pavel Sergeevich, Romanenko G. V. Galina, Kukushkin Vadim V. Yu.
Summary:Title screen
Organic nitroxide radicals – specifically chloro-, bromo, and iodo-substituted nitronyl nitroxides – exhibit self-assembly in crystalline states through the combined action of halogen (Hal···ONO) and hydrogen (ONO⋯HMe) bonds. Theoretical calculations reveal that halogen bonds primarily govern the association of these nitroxides. This halogen bonding facilitates the proximity of atoms carrying spin densities of opposite signs, thereby promoting ferromagnetic intermolecular exchange interactions. This research demonstrates, for the first time, that halogen bonding can establish channels facilitating ferromagnetic intermolecular exchange between paramagnetic centers in organic nitronyl nitroxide radicals. This breakthrough discovery expands the potential applications of halogen bonding in the supramolecular modulation of magnetic properties within high-spin clusters—a function that was previously attributed exclusively to hydrogen bonding
AM_Agreement
Sprog:engelsk
Udgivet: 2025
Fag:
Online adgang:https://doi.org/10.1016/j.matchemphys.2024.130252
Format: Electronisk Book Chapter
KOHA link:https://koha.lib.tpu.ru/cgi-bin/koha/opac-detail.pl?biblionumber=679570

MARC

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330 |a Organic nitroxide radicals – specifically chloro-, bromo, and iodo-substituted nitronyl nitroxides – exhibit self-assembly in crystalline states through the combined action of halogen (Hal···ONO) and hydrogen (ONO⋯HMe) bonds. Theoretical calculations reveal that halogen bonds primarily govern the association of these nitroxides. This halogen bonding facilitates the proximity of atoms carrying spin densities of opposite signs, thereby promoting ferromagnetic intermolecular exchange interactions. This research demonstrates, for the first time, that halogen bonding can establish channels facilitating ferromagnetic intermolecular exchange between paramagnetic centers in organic nitronyl nitroxide radicals. This breakthrough discovery expands the potential applications of halogen bonding in the supramolecular modulation of magnetic properties within high-spin clusters—a function that was previously attributed exclusively to hydrogen bonding 
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461 1 |t Materials Chemistry and Physics  |c Amsterdam  |n Elsevier Science Publishing Company Inc. 
463 1 |t Vol. 332  |v Article number 130252, 9 p.  |d 2025 
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701 1 |a Kudryavtseva  |b E. N.  |g Ekaterina 
701 1 |a Tretyakov  |b E. V.  |g Evgeny 
701 1 |a Gomila  |b R. M.  |g Rosa 
701 1 |a Frontera  |b A.  |g Antonio 
701 1 |a Dmitriev  |b A. А.  |g Alexey 
701 1 |a Gritsan  |b N. P.  |g Nina 
701 0 |a Debin Xia 
701 1 |a Efimov  |b N. N.  |g Nikolay 
701 1 |a Petunin  |b P. V.  |c chemist  |c Associate Professor of Tomsk Polytechnic University, Candidate of Chemical Sciences  |f 1982-  |g Pavel Vasilievich  |9 19933 
701 1 |a Postnikov  |b P. S.  |c organic chemist  |c Associate Professor of Tomsk Polytechnic University, Candidate of chemical sciences  |f 1984-  |g Pavel Sergeevich  |9 15465 
701 1 |a Romanenko  |b G. V.  |g Galina 
701 1 |a Kukushkin  |b Vadim  |g V. Yu. 
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