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Crystal Structure and Hirshfeld Surface Analysis of 1-(4-Chlorophenyl)-5-{4-[(2-methylphenyl)methoxy]phenyl}-1H-Pyrazole    
Yazarlar
Prof. Dr. Abdullah AYDIN
Kastamonu Üniversitesi, Türkiye
Mehmet Akkurt
Erciyes Üniversitesi, Türkiye
Sümeyye Turanlı
Adıyaman Üniversitesi, Türkiye
Erden Banoğlu
Gazi Üniversitesi, Türkiye
Nefise Özçelik
Aksaray Üniversitesi, Türkiye
Özet
The aim of the study is to explore the crystal structure and performe Hirshfeld surface analysis of l-(4-chlorophenyl)-5-{4-[(2-methylphenyl)methoxy]phenyl}-1H-pyrazole. In the title compound, C23H19C1N2O, the 4-chlorophenyl, 2-methylphenyl and benzene rings are oriented with dihedral angles of 71.22(10), 31.82(9) and 59.76(9)°, respectively, with respect to the pyrazole ring. Pairs of molecules are linked by intermolecular C-H⋯O hydrogen contacts with R22(8) ring motifs forming sheets lying parallel to (100). Furthermore C-H⋯π interactions also contribute to stabilizing the molecular packing. A Hirshfeld surface analysis has been used to confirm and quantify the supramolecular interactions which indicate that the most important contributions for the crystal packing are from H⋯H (42.5%) and H⋯C/C⋯H (35%) and H⋯Cl/Cl⋯H (12%) interactions.
Anahtar Kelimeler
Makale Türü Özgün Makale
Makale Alt Türü ESCI dergilerinde yayımlanan tam makale
Dergi Adı X-ray Structure Analysis Online
Dergi ISSN 1883-3578
Dergi Tarandığı Indeksler ESCI
Makale Dili İngilizce
Basım Tarihi 11-2021
Cilt No 37
Sayı 11
Sayfalar 77 / 79
Doi Numarası 10.2116/xraystruct.37.77
Makale Linki http://dx.doi.org/10.2116/xraystruct.37.77