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Crystal structure of rac-2,3-diphenyl-2,3,5,6-tetrahydro-4H-1,3-thiazin-4-one 1-oxide

In the title compound, C(16)H(15)NO(2)S [alternative name: rac-2,3-diphenyl-1,3-thia­zinan-4-one 1-oxide], the thia­zine ring exhibits an envelope conformation, with the S atom forming the flap. The sulfoxide O atom is in a pseudo-axial position on the thia­zine ring and is trans to the phenyl group...

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Detalles Bibliográficos
Autores principales: Yennawar, Hemant P., Yang, Ziwei, Silverberg, Lee J.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2016
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC5095828/
https://www.ncbi.nlm.nih.gov/pubmed/27840703
http://dx.doi.org/10.1107/S2056989016015395
Descripción
Sumario:In the title compound, C(16)H(15)NO(2)S [alternative name: rac-2,3-diphenyl-1,3-thia­zinan-4-one 1-oxide], the thia­zine ring exhibits an envelope conformation, with the S atom forming the flap. The sulfoxide O atom is in a pseudo-axial position on the thia­zine ring and is trans to the phenyl group on C-2. The phenyl rings form a dihedral angle of 89.47 (19)°. In this racemate crystal, homochiral mol­ecules form slabs parallel to (010) of thickness b/2 which then stack with alternating chirality in the b-axis direction. The stacking is aided by edge-to-face inter­actions between the phenyl rings of racemic mol­ecules. Within each of the single-enanti­omer slabs, the mol­ecules are held by C—H⋯O-type inter­actions, with an H⋯O distance of 2.30 Å, forming infinite chains along the c-axis direction, as well by the edge-to-face inter­actions between phenyl rings of neighboring mol­ecules in the a-axis direction.