Adelaide Research & Scholarship
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https://hdl.handle.net/2440/34872
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| Type: | Journal article |
| Title: | Increased stability of NO and NS heterocyclic carbenes? |
| Author: | Graham, David Carl Yates, Brian F. |
| Citation: | Australian Journal of Chemistry, 2004; 57(4):359-364 |
| Publisher: | CSIRO Publishing |
| Issue Date: | 2004 |
| ISSN: | 0004-9425 |
| School/Discipline: | School of Chemistry and Physics |
| Statement of Responsibility: | David C. Graham and Brian F. Yates |
| Abstract: | Density functional theory has been used to investigate the effects of alkylation and oxidation on the stability of NO and NS heterocyclic carbenes. While O- and S-alkylation leads to a dramatic increase in stability with respect to dimerization, oxidation of the NS heterocyclic carbene to form the sulphoxide appears to have the opposite effect. |
| Keywords: | computational chemistry; density functional theory; heterocyclic carbenes |
| Rights: | © CSIRO 2004 |
| DOI: | 10.1071/CH03248 |
| Appears in Collections: | Chemistry publications |
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