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Putting a New Spin on Supramolecular Metallacycles: Co 3 Triangle and Co 4 Square Bearing Tetrazine-Based Radicals as Bridges.
- Source :
-
Journal of the American Chemical Society [J Am Chem Soc] 2017 Aug 16; Vol. 139 (32), pp. 11040-11043. Date of Electronic Publication: 2017 Aug 02. - Publication Year :
- 2017
-
Abstract
- The synthesis of two new radical-bridged compounds [Co <subscript>3</subscript> (bptz) <subscript>3</subscript> (dbm) <subscript>3</subscript> ]·2toluene (1) and [Co <subscript>4</subscript> (bptz) <subscript>4</subscript> (dbm) <subscript>4</subscript> ]·4MeCN (2) (bptz = 3,6-bis(pyridyl)-1,2,4,5-tetrazine; dbm = 1,3-diphenyl-1,3-propanedionate) is reported. The presence of the ligand-centered radical has been confirmed by X-ray crystallography and SQUID magnetometry. These complexes are the first metallacycles bearing nitrogen heterocyclic radicals as bridges. Magnetic studies reveal strong antiferromagnetic metal···radical coupling with coupling constants of J = -67.5 and -66.8 cm <superscript>-1</superscript> for 1 and 2, respectively. DFT calculations further support the strong antiferromagnetic coupling between Co <superscript>II</superscript> ions and bptz radicals and confirm S = 3 and S = 4 spin ground states for 1 and 2, respectively.
Details
- Language :
- English
- ISSN :
- 1520-5126
- Volume :
- 139
- Issue :
- 32
- Database :
- MEDLINE
- Journal :
- Journal of the American Chemical Society
- Publication Type :
- Academic Journal
- Accession number :
- 28728414
- Full Text :
- https://doi.org/10.1021/jacs.7b06925