Crystal structure of 1-benzoyl-3-(4-fluorophenyl)thiourea

Crystal structure of 1-benzoyl-3-(4-fluorophenyl)thiourea

The title compound, C14H11FN2OS, contains two molecules (A and B) in the asymmetric unit, with different conformations. In molecule A, the dihedral angles between the central thiourea grouping and the phenyl and fluorobenzene rings are 28.77 (8) and 41.82 (8)°, respectively, and the dihedral angle b...

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Main Authors: Rabab Sharaf Jassas, Abdullah M. Asiri, Muhammad Nadeem Arshad, Mohie E. M. Zayed, Ghulam Mustafa
Format: Article
Language:English
Published: International Union of Crystallography 2014-09-01
Series:Acta Crystallographica Section E
Subjects:
crystal structure
thiourea
amide
hydrogen-bonded dimers
Online Access:http://scripts.iucr.org/cgi-bin/paper?S1600536814018376
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spelling doaj-d62fe795d2b442fdb35c7770af45fb8c2020-11-25T01:35:43ZengInternational Union of CrystallographyActa Crystallographica Section E1600-53682014-09-01709o1023o102410.1107/S1600536814018376hb7271Crystal structure of 1-benzoyl-3-(4-fluorophenyl)thioureaRabab Sharaf Jassas0Abdullah M. Asiri1Muhammad Nadeem Arshad2Mohie E. M. Zayed3Ghulam Mustafa4Chemistry Department, Faculty of Science, King Abdulaziz University, PO Box 80203, Jeddah 21589, Saudi ArabiaChemistry Department, Faculty of Science, King Abdulaziz University, PO Box 80203, Jeddah 21589, Saudi ArabiaChemistry Department, Faculty of Science, King Abdulaziz University, PO Box 80203, Jeddah 21589, Saudi ArabiaChemistry Department, Faculty of Science, King Abdulaziz University, PO Box 80203, Jeddah 21589, Saudi ArabiaDepartment of Chemistry, University of Gujrat, Gujrat 50700, PakistanThe title compound, C14H11FN2OS, contains two molecules (A and B) in the asymmetric unit, with different conformations. In molecule A, the dihedral angles between the central thiourea grouping and the phenyl and fluorobenzene rings are 28.77 (8) and 41.82 (8)°, respectively, and the dihedral angle between the ring planes is 70.02 (9)°. Equivalent data for molecule B are 8.46 (8), 47.78 (8) and 52.99 (9)°, respectively. Both molecules feature an intramolecular N—H...O hydrogen bond, which closes an S(6) ring. In the crystal, A+B dimers linked by pairs of N—H...S hydrogen bonds generate R22(8) loops.http://scripts.iucr.org/cgi-bin/paper?S1600536814018376crystal structurethioureaamidehydrogen-bonded dimers
collection DOAJ
language English
format Article
sources DOAJ
author Rabab Sharaf Jassas
Abdullah M. Asiri
Muhammad Nadeem Arshad
Mohie E. M. Zayed
Ghulam Mustafa
spellingShingle Rabab Sharaf Jassas
Abdullah M. Asiri
Muhammad Nadeem Arshad
Mohie E. M. Zayed
Ghulam Mustafa
Crystal structure of 1-benzoyl-3-(4-fluorophenyl)thiourea
Acta Crystallographica Section E
crystal structure
thiourea
amide
hydrogen-bonded dimers
author_facet Rabab Sharaf Jassas
Abdullah M. Asiri
Muhammad Nadeem Arshad
Mohie E. M. Zayed
Ghulam Mustafa
author_sort Rabab Sharaf Jassas
title Crystal structure of 1-benzoyl-3-(4-fluorophenyl)thiourea
title_short Crystal structure of 1-benzoyl-3-(4-fluorophenyl)thiourea
title_full Crystal structure of 1-benzoyl-3-(4-fluorophenyl)thiourea
title_fullStr Crystal structure of 1-benzoyl-3-(4-fluorophenyl)thiourea
title_full_unstemmed Crystal structure of 1-benzoyl-3-(4-fluorophenyl)thiourea
title_sort crystal structure of 1-benzoyl-3-(4-fluorophenyl)thiourea
publisher International Union of Crystallography
series Acta Crystallographica Section E
issn 1600-5368
publishDate 2014-09-01
description The title compound, C14H11FN2OS, contains two molecules (A and B) in the asymmetric unit, with different conformations. In molecule A, the dihedral angles between the central thiourea grouping and the phenyl and fluorobenzene rings are 28.77 (8) and 41.82 (8)°, respectively, and the dihedral angle between the ring planes is 70.02 (9)°. Equivalent data for molecule B are 8.46 (8), 47.78 (8) and 52.99 (9)°, respectively. Both molecules feature an intramolecular N—H...O hydrogen bond, which closes an S(6) ring. In the crystal, A+B dimers linked by pairs of N—H...S hydrogen bonds generate R22(8) loops.
topic crystal structure
thiourea
amide
hydrogen-bonded dimers
url http://scripts.iucr.org/cgi-bin/paper?S1600536814018376
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AT abdullahmasiri crystalstructureof1benzoyl34fluorophenylthiourea
AT muhammadnadeemarshad crystalstructureof1benzoyl34fluorophenylthiourea
AT mohieemzayed crystalstructureof1benzoyl34fluorophenylthiourea
AT ghulammustafa crystalstructureof1benzoyl34fluorophenylthiourea
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