Crystal structures of 2-(benzene-carbo-thio-yloxy)ethyl benzene-carbo-thio-ate and 2-(benzene-carbo-thio-yloxy)ethyl benzoate.

Acta Crystallogr E Crystallogr Commun

Department of Applied Chemistry and Biotechnology, Graduate School and Faculty of Engineering, Chiba University, 1-33 Yayoi-cho, Inage-ku, Chiba 263-8522, Japan.

Published: October 2017

The title compounds, CHOS and CHOS, which are monomeric models (models and ) for a polythio-noester and a poly(ester--thio-noester), respectively, crystallize in the space group 2/ and are isostructural with each other. The mol-ecule in each crystal is located on an inversion centre and has an all- structure. The asymmetric unit comprises one half-mol-ecule. In the crystal, there are inter-molecular C⋯S contacts [3.391 (3) and 3.308 (3) Å for models and , respectively] and C-H⋯π inter-actions, which form a layer structure parallel to the plane. The carbonyl and thio-carbonyl groups of the model compound are each disordered over two equivalent sites about the inversion centre with equal occupancies.

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http://www.ncbi.nlm.nih.gov/pmc/articles/PMC5730289PMC
http://dx.doi.org/10.1107/S2056989017012701DOI Listing

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