3-(3-Methoxybenzoyl)-1,1-diphenylthiourea

Mohd Faizal Md Nasir, Ibrahim N. Hassan, Bohari Mohd. Yamin, Wan Ramli Wan Daud, Mohammad Kassim

Research output: Contribution to journalArticle

6 Citations (Scopus)

Abstract

The thiono and carbonyl groups in the title compound, C 21H 18N 2O 2S, adopt an anti disposition with respect to the central C - N bond. The diphenyl-amine rings are twisted relative to each other by a dihedral angle of 82.55 (10)°. The 3-meth-oxy-benzoyl fragment is twisted relative to one of the diphenyl-amine rings, forming a dihedral angle of 74.04 (9)°. In the crystal, pairs of inter-molecular N - H⋯S hydrogen bonds link the molecules into centrosymmetric dimers, forming columns parallel to the a axis.

Original languageEnglish
JournalActa Crystallographica Section E: Structure Reports Online
Volume67
Issue number8
DOIs
Publication statusPublished - Aug 2011

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Dihedral angle
Amines
dihedral angle
amines
rings
Dimers
Hydrogen bonds
dimers
fragments
hydrogen bonds
Crystals
Molecules
crystals
molecules
diphenylthiourea
diphenyl

Keywords

  • data-to-parameter ratio = 15.1
  • mean σ(CC) = 0.003 Å
  • R factor = 0.038
  • single-crystal X-ray study
  • T = 298 K
  • wR factor = 0.110

ASJC Scopus subject areas

  • Condensed Matter Physics
  • Materials Science(all)
  • Chemistry(all)

Cite this

3-(3-Methoxybenzoyl)-1,1-diphenylthiourea. / Md Nasir, Mohd Faizal; Hassan, Ibrahim N.; Mohd. Yamin, Bohari; Wan Daud, Wan Ramli; Kassim, Mohammad.

In: Acta Crystallographica Section E: Structure Reports Online, Vol. 67, No. 8, 08.2011.

Research output: Contribution to journalArticle

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AU - Md Nasir, Mohd Faizal

AU - Hassan, Ibrahim N.

AU - Mohd. Yamin, Bohari

AU - Wan Daud, Wan Ramli

AU - Kassim, Mohammad

PY - 2011/8

Y1 - 2011/8

N2 - The thiono and carbonyl groups in the title compound, C 21H 18N 2O 2S, adopt an anti disposition with respect to the central C - N bond. The diphenyl-amine rings are twisted relative to each other by a dihedral angle of 82.55 (10)°. The 3-meth-oxy-benzoyl fragment is twisted relative to one of the diphenyl-amine rings, forming a dihedral angle of 74.04 (9)°. In the crystal, pairs of inter-molecular N - H⋯S hydrogen bonds link the molecules into centrosymmetric dimers, forming columns parallel to the a axis.

AB - The thiono and carbonyl groups in the title compound, C 21H 18N 2O 2S, adopt an anti disposition with respect to the central C - N bond. The diphenyl-amine rings are twisted relative to each other by a dihedral angle of 82.55 (10)°. The 3-meth-oxy-benzoyl fragment is twisted relative to one of the diphenyl-amine rings, forming a dihedral angle of 74.04 (9)°. In the crystal, pairs of inter-molecular N - H⋯S hydrogen bonds link the molecules into centrosymmetric dimers, forming columns parallel to the a axis.

KW - data-to-parameter ratio = 15.1

KW - mean σ(CC) = 0.003 Å

KW - R factor = 0.038

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KW - T = 298 K

KW - wR factor = 0.110

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