Crystal structure of luliconazole

The crystal structure of luliconazole {LCZ; C<sub>14</sub>H<sub>9</sub>Cl<sub>2</sub>N<sub>3</sub>S<sub>2</sub>; systematic name: (<i>E</i>)-[(4<i>R</i>)-4-(2,4-di-chloro-phen-yl)-1,3-di-thio-lan-2-yl-idene](1<i>H</i>-imidazol-1-yl)aceto-nitrile} is reported. In the mol-ecule of the title compound, the di-thiol-ane ring adopts an envelope conformation, while the di-chloro-phenyl ring exhibits disorder. In the crystal packing of luliconazole, only two inter-molecular C-H⋯N hydrogen bonds are observed. Hirshfeld surface analysis reveals that the most dominant contacts are H⋯N/N⋯H, H⋯Cl/Cl⋯H, H⋯H and C⋯H/H⋯C.

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Publication Details

Journal
Acta Crystallographica Section E Crystallographic Communications
Published
2024-12-10
DOI
https://doi.org/10.1107/s2056989024011812
Primary Topic
Veterinary medicine and infectious diseases
Type
article
Field-Weighted Citation Impact
0.00

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article

Crystal structure of luliconazole

Lilianna Chęcińska, Anna Ben
Acta Crystallographica Section E Crystallographic Communications
Veterinary medicine and infectious diseases
article

Crystal structure of luliconazole

Lilianna Chęcińska, Anna Ben
article en

Abstract

The crystal structure of luliconazole {LCZ; C<sub>14</sub>H<sub>9</sub>Cl<sub>2</sub>N<sub>3</sub>S<sub>2</sub>; systematic name: (<i>E</i>)-[(4<i>R</i>)-4-(2,4-di-chloro-phen-yl)-1,3-di-thio-lan-2-yl-idene](1<i>H</i>-imidazol-1-yl)aceto-nitrile} is reported. In the mol-ecule of the title compound, the di-thiol-ane ring adopts an envelope conformation, while the di-chloro-phenyl ring exhibits disorder. In the crystal packing of luliconazole, only two inter-molecular C-H⋯N hydrogen bonds are observed. Hirshfeld surface analysis reveals that the most dominant contacts are H⋯N/N⋯H, H⋯Cl/Cl⋯H, H⋯H and C⋯H/H⋯C.

Acta Crystallographica Section E Crystallographic CommunicationsVol. 81(1)
University of Łódź (PL), Exact Sciences (United States) (US)
Uniwersytet Łódzki
Clean water and sanitation
Openalex Percentile: Top 73%
Veterinary medicine and infectious diseases
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