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Bis-cyclic(alkyl)(amino)carbene-derived diradicals

Nayak, MK and Elvers, BJ and Mehta, S and Krummenacher, I and Mondal, A and Braunschweig, H and Schulzke, C and Ravat, P and Jana, A (2023) Bis-cyclic(alkyl)(amino)carbene-derived diradicals. In: Chemical Communications .

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Official URL: https://doi.org/10.1039/d3cc05779h


Crystalline polymeric structures of trans-1,4-cyclohexylene bridged N-tethered bis-CAACs in the form of their LiOTf adducts were synthesized and isolated. These were further used as building blocks for the synthesis of crystalline (amino)(carboxy)-based diradicals. The triplet diradical character of these compounds was unambiguously confirmed by the presence of a half-field signal in their EPR spectra. Theoretical calculations show that the singlet state is marginally more stable than the triplet state. © 2024 The Royal Society of Chemistry.

Item Type: Journal Article
Publication: Chemical Communications
Publisher: Royal Society of Chemistry
Additional Information: The copyright for this article belongs to Royal Society of Chemistry.
Keywords: Building blockes; Carbenes; Crystalline polymeric structures; Diradicals; EPR spectrum; Singlet state; Synthesised; Theoretical calculations; Triplet state, Electron spin resonance spectroscopy
Department/Centre: Division of Chemical Sciences > Solid State & Structural Chemistry Unit
Date Deposited: 01 Mar 2024 10:09
Last Modified: 01 Mar 2024 10:09
URI: https://eprints.iisc.ac.in/id/eprint/84040

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