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3-(Benzothia­zol-2-yl)-3-(prop-2-yn­yl)hex-5-yn-2-one

The title compound, C(16)H(13)NOS, was prepared by alkyl­ation of 1-(benzothia­zol-2-yl)propan-2-one with propargyl bromide. The asymmetric unit contains two mol­ecules that are crystallographically independent but linked to each other by non-classical C—H⋯O hydrogen bonds, building up a dimeric sub...

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Detalles Bibliográficos
Autores principales: Baryala, Yamna, Zerzouf, Abdelfettah, Salem, Moussa, Essassi, El Mokhtar, El Ammari, Lahcen
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2010
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2983859/
https://www.ncbi.nlm.nih.gov/pubmed/21580680
http://dx.doi.org/10.1107/S1600536810009293
Descripción
Sumario:The title compound, C(16)H(13)NOS, was prepared by alkyl­ation of 1-(benzothia­zol-2-yl)propan-2-one with propargyl bromide. The asymmetric unit contains two mol­ecules that are crystallographically independent but linked to each other by non-classical C—H⋯O hydrogen bonds, building up a dimeric substructure. The benzothia­zole rings are essentially planar with maximum deviations of 0.005 (1) and 0.007 (2) Å for the N atoms. Although the two mol­ecules have similar bond distances and angles, they slightly differ in the orientation of the benzothia­zole ring with respect to the two propargyl groups and the acetonyl unit . In the crystal, inter­molecular C—H⋯O inter­actions link the dimeric subunits into a two-dimensional array in the bc plane.