Ferromagnetic Interactionswithin a Dimer of a π‑Extended1,2,4-Benzotriazin-4-yl

1,3,7-Triphenyl-4,8-dihydro-1<i>H</i>-imidazo[4,5-<i>g</i>][1,2,4]benzo­triazin-4-yl, a stable radical, forms 1 D π stacks. These stacks consist of dimers with alternating interplanar distances measuring 3.443 Å (short) and 4.169 Å (long). Magnetic susceptibility (χ<i>T</i>) reaches its peak at 18 ± 4 K, signifying the presence of a dimer with ferromagnetic interactions, quantified by 2<i>J</i> = 18.1 cm<sup>–1</sup>. The magneto-structural relationship is corroborated by DFT calculations.

Publication Details

Journal
Figshare
Published
2025-02-06
DOI
https://doi.org/10.1021/acs.cgd.4c01508.s001
Primary Topic
Potato Plant Research
Type
article
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article

Ferromagnetic Interactionswithin a Dimer of a π‑Extended1,2,4-Benzotriazin-4-yl

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Potato Plant Research
article

Ferromagnetic Interactionswithin a Dimer of a π‑Extended1,2,4-Benzotriazin-4-yl

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Abstract

1,3,7-Triphenyl-4,8-dihydro-1<i>H</i>-imidazo[4,5-<i>g</i>][1,2,4]benzo­triazin-4-yl, a stable radical, forms 1 D π stacks. These stacks consist of dimers with alternating interplanar distances measuring 3.443 Å (short) and 4.169 Å (long). Magnetic susceptibility (χ<i>T</i>) reaches its peak at 18 ± 4 K, signifying the presence of a dimer with ferromagnetic interactions, quantified by 2<i>J</i> = 18.1 cm<sup>–1</sup>. The magneto-structural relationship is corroborated by DFT calculations.

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Potato Plant Research
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Ferromagnetic Interactionswithin a Dimer of a π‑Extended1,2,4-Benzotriazin-4-yl · Figshare (2025) | TGRS Research Map | TGRS