Abstract
The title compound, C23H23ClN2O2S, was synthesized by the nucleophilic substitution of 1-benzhydrylpiperazine with 4-chlorophenylsulfonyl chloride. The piperazine ring is in a chair conformation. The geometry around the S atom is that of a distorted tetrahedron. There is a large range of bond angles around the piperazine N atoms. The dihedral angle between the least-squares plane (p1) defined by the four coplanar C atoms of the piperazine ring and the benzene ring is 81.6 (1)°. The dihedral angles between p1 and the phenyl rings are 76.2 (1) and 72.9 (2)°. The two phenyl rings make a dihedral angle of 65.9 (1)°. Intramolecular C—H⋯O hydrogen bonds are present.
Highlights
The title compound, C23H23ClN2O2S, was synthesized by the nucleophilic substitution of 1-benzhydrylpiperazine with 4chlorophenylsulfonyl chloride
The piperazine ring is in a chair conformation
The geometry around the S atom is that of a distorted tetrahedron
Summary
Key indicators: single-crystal X-ray study; T = 295 K; mean (C–C) = 0.004 A; R factor = 0.051; wR factor = 0.147; data-to-parameter ratio = 14.5. The piperazine ring is in a chair conformation. The geometry around the S atom is that of a distorted tetrahedron. There is a large range of bond angles around the piperazine N atoms. The dihedral angle between the least-squares plane (p1) defined by the four coplanar C atoms of the piperazine ring and the benzene ring is 81.6 (1). The two phenyl rings make a dihedral angle of 65.9 (1). Intramolecular C—HÁ Á ÁO hydrogen bonds are present.
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More From: Acta Crystallographica Section E Structure Reports Online
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