Firudin I. Guseinov , Ksenia A. Afanaseva , Vera A.Vil , Bogdan I. Ugrak , Aida I. Samigullina , Ennio Zangrando , Alebel N. Belay
{"title":"Crystal structure of 1-[(4-chlorophenyl)diphenylylmethyl]-3-(trifluoromethyl)-1H-pyrazole","authors":"Firudin I. Guseinov , Ksenia A. Afanaseva , Vera A.Vil , Bogdan I. Ugrak , Aida I. Samigullina , Ennio Zangrando , Alebel N. Belay","doi":"10.1107/S2056989025001185","DOIUrl":null,"url":null,"abstract":"<div><div>The title pyrazole derivative, which exhibits multiple intermolecular non-covalent interactions, was synthesized by the reaction of 3-(trifluoromethyl)-1<em>H</em>-pyrazole with chloro(4-chlorophenyl)methylene)dibenzene in the presence of K<sub>2</sub>CO<sub>3</sub> in tetrahydrofuran.</div></div><div><div>The title compound, C<sub>23</sub>H<sub>16</sub>ClF<sub>3</sub>N<sub>2</sub>, was synthesized from 3-(trifluoromethyl)-1<em>H</em>-pyrazole and chloro(4-chlorophenyl)methylene)dibenzene. The structure features intramolecular (Ph)C—H⋯N and intermolecular (Ph)C—H⋯F hydrogen bonds, as well as C—H⋯π-ring interactions between the phenyl and pyrazole rings.</div></div>","PeriodicalId":7367,"journal":{"name":"Acta Crystallographica Section E: Crystallographic Communications","volume":"81 3","pages":"Pages 235-238"},"PeriodicalIF":0.5000,"publicationDate":"2025-03-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://www.ncbi.nlm.nih.gov/pmc/articles/PMC11891583/pdf/","citationCount":"0","resultStr":null,"platform":"Semanticscholar","paperid":null,"PeriodicalName":"Acta Crystallographica Section E: Crystallographic Communications","FirstCategoryId":"1085","ListUrlMain":"https://www.sciencedirect.com/org/science/article/pii/S2056989025000519","RegionNum":0,"RegionCategory":null,"ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q4","JCRName":"CRYSTALLOGRAPHY","Score":null,"Total":0}
引用次数: 0
Abstract
The title pyrazole derivative, which exhibits multiple intermolecular non-covalent interactions, was synthesized by the reaction of 3-(trifluoromethyl)-1H-pyrazole with chloro(4-chlorophenyl)methylene)dibenzene in the presence of K2CO3 in tetrahydrofuran.
The title compound, C23H16ClF3N2, was synthesized from 3-(trifluoromethyl)-1H-pyrazole and chloro(4-chlorophenyl)methylene)dibenzene. The structure features intramolecular (Ph)C—H⋯N and intermolecular (Ph)C—H⋯F hydrogen bonds, as well as C—H⋯π-ring interactions between the phenyl and pyrazole rings.
期刊介绍:
Acta Crystallographica Section E: Crystallographic Communications is the IUCr''s open-access structural communications journal. It provides a fast, simple and easily accessible publication mechanism for crystal structure determinations of inorganic, metal-organic and organic compounds. The electronic submission, validation, refereeing and publication facilities of the journal ensure rapid and high-quality publication of fully validated structures. The primary article category is Research Communications; these are peer-reviewed articles describing one or more structure determinations with appropriate discussion of the science.