Crystal structure of 3-[2-(thio-phen-3-yl)ethyn-yl]-2H-chromen-2-one

Acta Crystallogr E Crystallogr Commun. 2015 Feb 7;71(Pt 3):o154-5. doi: 10.1107/S2056989015002157. eCollection 2015 Mar 1.

Abstract

In the title compound, C15H8O2S, the coumarin moiety is approximately planar (r.m.s. deviation of the 11 non-H atoms = 0.025 Å) and is slightly inclined with respect to the plane of the thio-phen-3-yl ring, forming a dihedral angle of 11.75 (8)°. In the crystal, the three-dimensional architecture features a combination of coumarin-thio-phene C-H⋯π and π-π [inter-centroid distance = 3.6612 (12) Å] inter-actions.

Keywords: C—H⋯π inter­actions; asymmetric alkyne; coumarin; crystal structure; π–π inter­actions.