Year-end Sale % OFF 
Abstract
There are two symmetry-independent molecules, A and B, in the asymmetric unit of the title compound, C17H14FIO3S. The dihedral angle formed by the 4-fluorophenyl ring and the mean plane [r.m.s. deviation = 0.013 (2) Å in molecule A and 0.016 (2) Å in molecule B] of the benzofuran fragment is 57.71 (7)° in molecule A and 44.95 (7)° in molecule B. In the crystal, molecules are linked by weak C—H⋯O hydrogen bonds and I⋯O contacts [I⋯O = 3.3646 (15) and 3.2354 (14) Å], forming a three--dimensional network.
Highlights
There are two symmetry-independent molecules, A and B, in the asymmetric unit of the title compound, C17H14FIO3S
As a part of our ongoing study of 2-(4-fluorophenyl)-5-iodo-1-benzofuran derivatives containing ethylsulfinyl (Choi et al, 2010a) and isopropylsulfinyl (Choi et al, 2010b) substituents in 3-position, we report the crystal structure of the title compound which crystallizes with two symmetrically independent molecules, A and B, in the asymmetric unit
Symmetry codes: (iii) −x+1, −y+2, −z; (iv) −x+2, −y+1, −z+1; (v) x−1, y, z
Summary
R factor = 0.025; wR factor = 0.060; data-to-parameter ratio = 19.4. Hydrogen-bond geometry (Å, ). There are two symmetry-independent molecules, A and B, in the asymmetric unit of the title compound, C17H14FIO3S. The dihedral angle formed by the 4-fluorophenyl ring and the mean plane [r.m.s. deviation = 0.013 (2) Å in molecule A and 57.71 (7) in molecule A and 44.95 (7) in molecule B. In the crystal, molecules are linked by weak C—H O hydrogen bonds and I O contacts [I O = 3.3646 (15) and 3.2354 (14) Å], forming a three–dimensional network.
Sign-in/Register to view highlights & summary Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Schedule a callMore From: Acta Crystallographica Section E Structure Reports Online
Disclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.
