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Characterisation of isothiocyanic acid, HNCS, in the solid state: trapped by hydrogen bonding

Nuzzo, Stefano, Twamley, Brendan, Platts, James Alexis and Baker, Robert J. 2016. Characterisation of isothiocyanic acid, HNCS, in the solid state: trapped by hydrogen bonding. Chemical Communications 52 (90) , pp. 13296-13298. 10.1039/C6CC05971F

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Abstract

The crystal structure of [Ph4P][NCS]·HNCS is reported. This is the first structural determination of isothiocyanic acid and hydrogen bonding between the NCS anion and HNCS fragment explored using computational chemistry.

Item Type: Article
Date Type: Published Online
Status: Published
Schools: Chemistry
Advanced Research Computing @ Cardiff (ARCCA)
Subjects: Q Science > QD Chemistry
Publisher: Royal Society of Chemistry
ISSN: 1359-7345
Date of First Compliant Deposit: 29 November 2016
Date of Acceptance: 21 October 2016
Last Modified: 13 Aug 2019 12:33
URI: http://orca-mwe.cf.ac.uk/id/eprint/96480

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