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Crystal structure of 3-({[(morpholin-4-yl)carbono-thio-yl]sulfan-yl}acet-yl)phenyl benzoate.

ABSTRACT: In the title compound, C20H19NO4S2, the morpholine ring adopts the expected chair conformation. The central phenyl ring makes dihedral angles of 67.97?(4) and 7.74?(3)°, respectively, with the benzoate phenyl ring and the morpholine mean plane. In the crystal, mol-ecules are linked by C-H?O hydrogen bonds, forming zigzag chains along the b-axis direction. C-H?? inter-actions link centrosymmetrically related mol-ecules, reinforcing the three-dimensional structure.

SUBMITTER: Ambekar SP

PROVIDER: S-EPMC4257286 | biostudies-literature | 2014 Nov

REPOSITORIES: biostudies-literature

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Crystal structure of 3-({[(morpholin-4-yl)carbono-thio-yl]sulfan-yl}acet-yl)phenyl benzoate.

Ambekar Sachin P SP Mahesh Kumar K K Shirahatti Arun Kumar M AK Kotresh O O Anil Kumar G N GN

Acta crystallographica. Section E, Structure reports online 20141024 Pt 11

In the title compound, C20H19NO4S2, the morpholine ring adopts the expected chair conformation. The central phenyl ring makes dihedral angles of 67.97 (4) and 7.74 (3)°, respectively, with the benzoate phenyl ring and the morpholine mean plane. In the crystal, mol-ecules are linked by C-H⋯O hydrogen bonds, forming zigzag chains along the b-axis direction. C-H⋯π inter-actions link centrosymmetrically related mol-ecules, reinforcing the three-dimensional structure. ...[more]

PMID: 25484757

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