Bis[1,2-bis(4-fluorophenyl)ethylene-1,2-dithiolato(1−)]nickel(II)

The crystal structure of the title compound, [Ni(C<sub>14</sub>H<sub>8</sub>F<sub>2</sub>S<sub>2</sub>)<sub>2</sub>] (<b>I</b>), reveals averaged S-C [1.708 (2) Å] and C-C<sub>chelate</sub> [1.395 (4) Å] bond lengths that are consistent with radical monoanionic ligands paired with a divalent Ni<sup>2+</sup> ion. Mol-ecules of <b>I</b> associate as dyads <i>via</i> inter-molecular Ni⋯S close contacts of 3.396 (2) Å. This close association is enabled by a bending of both di-thiol-ene ligands to the same side and away from the NiS<sub>4</sub> planar inter-ior such that the angle between the seven atom mean planes defined by each NiS<sub>2</sub>C<sub>2</sub> ring and the first C atom of each aryl substituent is 22.91 (8)°. These dyads form sheets in the <i>bc</i> plane that are held together in part by inter-molecular C-H⋯F hydrogen bonds of 2.47 (4) Å.

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Publication Details

Journal
Acta Crystallographica Section E Crystallographic Communications
Published
2025-08-18
DOI
https://doi.org/10.1107/s2056989025007303
Primary Topic
Organic and Molecular Conductors Research
Type
article
Field-Weighted Citation Impact
0.00

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article

Bis[1,2-bis(4-fluorophenyl)ethylene-1,2-dithiolato(1−)]nickel(II)

Xiao-Dong Zhang, Titir Das Gupta, James P. Donahue, Laura Fiabane
Acta Crystallographica Section E Crystallographic Communications
Organic and Molecular Conductors Research
article

Bis[1,2-bis(4-fluorophenyl)ethylene-1,2-dithiolato(1−)]nickel(II)

Xiao-Dong Zhang, Titir Das Gupta, James P. Donahue, Laura Fiabane
article en

Abstract

The crystal structure of the title compound, [Ni(C<sub>14</sub>H<sub>8</sub>F<sub>2</sub>S<sub>2</sub>)<sub>2</sub>] (<b>I</b>), reveals averaged S-C [1.708 (2) Å] and C-C<sub>chelate</sub> [1.395 (4) Å] bond lengths that are consistent with radical monoanionic ligands paired with a divalent Ni<sup>2+</sup> ion. Mol-ecules of <b>I</b> associate as dyads <i>via</i> inter-molecular Ni⋯S close contacts of 3.396 (2) Å. This close association is enabled by a bending of both di-thiol-ene ligands to the same side and away from the NiS<sub>4</sub> planar inter-ior such that the angle between the seven atom mean planes defined by each NiS<sub>2</sub>C<sub>2</sub> ring and the first C atom of each aryl substituent is 22.91 (8)°. These dyads form sheets in the <i>bc</i> plane that are held together in part by inter-molecular C-H⋯F hydrogen bonds of 2.47 (4) Å.

Acta Crystallographica Section E Crystallographic CommunicationsVol. 81(9)
Tulane University (US), Catholic Medical Center (US)
Directorate for Mathematical and Physical Sciences
Openalex Percentile: Top 86%
Organic and Molecular Conductors Research
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Bis[1,2-bis(4-fluorophenyl)ethylene-1,2-dithiolato(1−)]nickel(II) — Xiao-Dong Zhang, Titir Das Gupta, et al. · Acta Crystallographica Section E Crystallographic Communications (2025) | TGRS Research Map | TGRS