5-Bromo-3-ethyl-sulfinyl-7-methyl-2-(4-methyl-phen-yl)-1-benzo-furan.

Acta Crystallogr Sect E Struct Rep Online

Department of Chemistry, Pukyong National University, 599-1 Daeyeon 3-dong, Nam-gu, Busan 608-737, Republic of Korea.

Published: April 2014

AI Article Synopsis

Article Abstract

In the title compound, C18H17BrO2S, the dihedral angle between the mean planes of the benzo-furan and 4-methyl-phenyl rings is 14.54 (5)°. In the crystal, mol-ecules are linked via pairs of π-π inter-actions between the benzene and 4-methyl-phenyl rings, with centroid-centroid distances of 3.811 (3) and 3.755 (3) Å. A similar inter-action is found between the furan and 4-methyl-phenyl rings, with a centroid-centroid distance of 3.866 (3) Å between neighbouring mol-ecules. The mol-ecules are stacked along the a-axis direction. In addition, a short Br⋯O contact distance of 3.128 (2) Å is observed between inversion-related dimers.

Download full-text PDF

Source
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC3998609PMC
http://dx.doi.org/10.1107/S1600536814005844DOI Listing

Publication Analysis

Top Keywords

4-methyl-phenyl rings
12
rings centroid-centroid
8
5-bromo-3-ethyl-sulfinyl-7-methyl-2-4-methyl-phen-yl-1-benzo-furan title
4
title compound
4
compound c18h17bro2s
4
c18h17bro2s dihedral
4
dihedral angle
4
angle planes
4
planes benzo-furan
4
benzo-furan 4-methyl-phenyl
4

Similar Publications

Want AI Summaries of new PubMed Abstracts delivered to your In-box?

Enter search terms and have AI summaries delivered each week - change queries or unsubscribe any time!