3,3'-(1-Oxopropane-1,3-diyl)bis(1,3-thiazolidine-2-thione) Chlorobenzene Hemisolvate

Abstract

The title compound, C9H12N2OS4*0.5C6H5Cl, which contains two 1,3-thiazolidine-2-thione rings, is a by-product of the synthesis of 3-acryloyl-1,3-thiazolidine-2-thione. The dihedral angle between these rings is 79.95 (9) deg., with both rings displaying a twisted conformation. The twist angle of the amide group is 5.6 (1) deg. In the crystal, the molecules are linked into [001] chains by C--H...O interactions. The chlorobenzene solvent molecule was found to show unresolvable disorder about a centre of inversion and its contribution to the scattering was removed with the SQUEEZE option in PLATON [Spek (2009). Acta Cryst. D65, 148 155].

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Document Details

Document Type
Technical Report
Publication Date
Jan 01, 2013
Accession Number
ADA581116

Entities

People

  • Andrew P Purdy
  • Christine Franzel
  • Ray J Butcher

Organizations

  • United States Naval Research Laboratory

Tags

Communities of Interest

  • Air Platforms

DTIC Thesaurus Topics

  • Abstracts
  • Chemical Compounds
  • Chemical Synthesis
  • Chemistry
  • Chlorobenzene
  • Crystals
  • Data Reduction
  • Dihedral Angle
  • Geometry
  • Hydrogen Bonds
  • Materials
  • Military Research
  • Molecules
  • Organic Compounds
  • Reflection
  • Scattering
  • X Rays

Fields of Study

  • Chemistry

Readers

  • Materials Science and Engineering.
  • Organic Chemistry
  • Tribology (the study of the boundary interaction between sliding surfaces, lubrication, wear and friction).