Ahn, Shinbyoung, PrakashaReddy, J., Kariuki, Benson  ORCID: https://orcid.org/0000-0002-8658-3897, Chatterjee, Swati, Ranganathan, Anupama, Pedireddi, V. R., Rao, C. N. R. and Harris, Kenneth David Maclean ORCID: https://orcid.org/0000-0001-7855-8598
2005.
Structural rationalisation of co-crystals formed between trithiocyanuric acid and molecules containing hydrogen bonding functionality.
Chemistry-a European Journal
11
(8)
, pp. 2433-2439.
10.1002/chem.200400340
|
Abstract
Crystallisation of trithiocyanuric acid (TTCA) from various organic solvents that have hydrogen bonding capability (acetone, 2-butanone, dimethylformamide, dimethyl sulfoxide, methanol and acetonitrile) leads to the formation of co-crystals in which the solvent molecules are incorporated together with TTCA in the crystal structure. Structure determination by single-crystal X-ray diffraction reveals that these co-crystals can be classified into different groups depending upon the topological arrangement of the TTCA molecules in the crystal structure. Thus, three different types of single-tape arrangements of TTCA molecules and one type of double-tape arrangement of TTCA molecules are identified. In all co-crystals, hydrogen-bonding interactions are formed through the involvement of NH bonds of TTCA molecules in these tapes and the other molecule in the co-crystal. Detailed rationalisation of the structural properties of these co-crystals is presented.
| Item Type: | Article |
|---|---|
| Status: | Published |
| Schools: | Schools > Chemistry |
| Subjects: | Q Science > QD Chemistry |
| Uncontrolled Keywords: | crystal engineering ; hydrogen bonds ;nitrogen heterocycles ; structure elucidation |
| Publisher: | WileyBlackwell |
| ISSN: | 0947-6539 |
| Last Modified: | 18 Oct 2022 13:10 |
| URI: | https://orca.cardiff.ac.uk/id/eprint/12762 |
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