The University of Southampton
University of Southampton Institutional Repository

Supramolecular polymers of 4,5-bis(bromomethyl)-1,3-dithiole-2-thione-dihalogen adducts

Supramolecular polymers of 4,5-bis(bromomethyl)-1,3-dithiole-2-thione-dihalogen adducts
Supramolecular polymers of 4,5-bis(bromomethyl)-1,3-dithiole-2-thione-dihalogen adducts
The title compound has been reacted with I-2, IBr and ICl to afford the charge-transfer adducts 4.2I(2), 4.IBr and 4.ICl.I-2, respectively. The products have been characterised by Raman and IR spectroscopy and X-ray crystallography. The adducts contain linear S...I-X (X=I, Br or Cl) units (174-178degrees) in which the S...I contacts range from 2.534-2.597 AAngstrom. In 4.2I(2) and 4.ICl.I-2, the materials contain additional 'free' diiodine units which are held within a matrix of intermolecular contacts, predominantly through non-covalent halogen halogen and sulfur-halogen interactions. Although the functional groups in the parent molecule (4) are inert at the supramolecular level, the bromomethyl groups in the adducts contribute strong interactions through Br...Br, Br...I, Br...S and Br...H close contacts. The structures of the complexes are polymeric in nature, providing interactions in two and three dimensions.
halogen-halogen interactions, iodine monobromide, crystal, dihalogens, molecules, sulfur, bromo
1466-8033
612-617
Lee, Louise
0769d5a1-89d9-41b7-bab7-503c1b89c9c3
Crouch, David J.
b026fc2c-b90b-4c63-958e-ed3dd0a6437a
Wright, Shaun P.
bd48b4e5-7da3-4f55-b19d-819933e3c9a3
Berridge, Rory
6aa42596-b293-4914-a1eb-2a974e7f2ed4
Skabara, Peter J.
7138e414-7d50-41c7-933e-0bccad2fa4cd
Bricklebank, Neil
6e082c98-a747-4690-bb37-f05f24d621f5
Coles, Simon J.
3116f58b-c30c-48cf-bdd5-397d1c1fecf8
Light, Mark E.
cf57314e-6856-491b-a8d2-2dffc452e161
Hursthouse, Michael B.
57a2ddf9-b1b3-4f38-bfe9-ef2f526388da
Lee, Louise
0769d5a1-89d9-41b7-bab7-503c1b89c9c3
Crouch, David J.
b026fc2c-b90b-4c63-958e-ed3dd0a6437a
Wright, Shaun P.
bd48b4e5-7da3-4f55-b19d-819933e3c9a3
Berridge, Rory
6aa42596-b293-4914-a1eb-2a974e7f2ed4
Skabara, Peter J.
7138e414-7d50-41c7-933e-0bccad2fa4cd
Bricklebank, Neil
6e082c98-a747-4690-bb37-f05f24d621f5
Coles, Simon J.
3116f58b-c30c-48cf-bdd5-397d1c1fecf8
Light, Mark E.
cf57314e-6856-491b-a8d2-2dffc452e161
Hursthouse, Michael B.
57a2ddf9-b1b3-4f38-bfe9-ef2f526388da

Lee, Louise, Crouch, David J., Wright, Shaun P., Berridge, Rory, Skabara, Peter J., Bricklebank, Neil, Coles, Simon J., Light, Mark E. and Hursthouse, Michael B. (2004) Supramolecular polymers of 4,5-bis(bromomethyl)-1,3-dithiole-2-thione-dihalogen adducts. CrystEngComm, 6, 612-617. (doi:10.1039/b416813p).

Record type: Article

Abstract

The title compound has been reacted with I-2, IBr and ICl to afford the charge-transfer adducts 4.2I(2), 4.IBr and 4.ICl.I-2, respectively. The products have been characterised by Raman and IR spectroscopy and X-ray crystallography. The adducts contain linear S...I-X (X=I, Br or Cl) units (174-178degrees) in which the S...I contacts range from 2.534-2.597 AAngstrom. In 4.2I(2) and 4.ICl.I-2, the materials contain additional 'free' diiodine units which are held within a matrix of intermolecular contacts, predominantly through non-covalent halogen halogen and sulfur-halogen interactions. Although the functional groups in the parent molecule (4) are inert at the supramolecular level, the bromomethyl groups in the adducts contribute strong interactions through Br...Br, Br...I, Br...S and Br...H close contacts. The structures of the complexes are polymeric in nature, providing interactions in two and three dimensions.

This record has no associated files available for download.

More information

Published date: 24 November 2004
Keywords: halogen-halogen interactions, iodine monobromide, crystal, dihalogens, molecules, sulfur, bromo

Identifiers

Local EPrints ID: 20267
URI: http://eprints.soton.ac.uk/id/eprint/20267
ISSN: 1466-8033
PURE UUID: 94749c60-4963-4042-9cce-789faa9f60ee
ORCID for Simon J. Coles: ORCID iD orcid.org/0000-0001-8414-9272
ORCID for Mark E. Light: ORCID iD orcid.org/0000-0002-0585-0843

Catalogue record

Date deposited: 20 Feb 2006
Last modified: 16 Mar 2024 03:05

Export record

Altmetrics

Contributors

Author: Louise Lee
Author: David J. Crouch
Author: Shaun P. Wright
Author: Rory Berridge
Author: Peter J. Skabara
Author: Neil Bricklebank
Author: Simon J. Coles ORCID iD
Author: Mark E. Light ORCID iD

Download statistics

Downloads from ePrints over the past year. Other digital versions may also be available to download e.g. from the publisher's website.

View more statistics

Atom RSS 1.0 RSS 2.0

Contact ePrints Soton: eprints@soton.ac.uk

ePrints Soton supports OAI 2.0 with a base URL of http://eprints.soton.ac.uk/cgi/oai2

This repository has been built using EPrints software, developed at the University of Southampton, but available to everyone to use.

We use cookies to ensure that we give you the best experience on our website. If you continue without changing your settings, we will assume that you are happy to receive cookies on the University of Southampton website.

×