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1,3-Bis(2,6-diisopropylphenyl)-2-trichloromethylimidazolidine

Title: 1,3-Bis(2,6-diisopropylphenyl)-2-trichloromethylimidazolidine
Authors: Stack, Darcie L.; Masuda, Jason Douglas, 1977-
Publisher Information: MDPI
Publication Year: 2017
Collection: Saint Mary's University, Halifax: Institutional Repository
Subject Terms: Chloroform; Heterocyclic compounds; Carbenes (Methylene compounds)
Description: Published Version ; A new chloroform adduct of the N-heterocyclic carbene (NHC) 1,3-bis(2,6-diisopropylphenyl)imidazolidin-2-ylidene (SIPr) has been prepared via C–H bond activation of the chloroform at the carbene carbon. This redox product was crystallized and was characterized by 1 H and 13 C-NMR spectroscopy, elemental analysis (EA), and single-crystal X-ray diffraction. The 1 H and 13 C-NMR spectroscopic data are in agreement with the crystal structure. Density functional theory (DFT) calculations were performed as a means for comparison to experimental data and the computational results are in agreement with those obtained experimentally.
Document Type: text
File Description: application/pdf
Language: English
Relation: http://library2.smu.ca/xmlui/handle/01/29788
Availability: http://library2.smu.ca/xmlui/handle/01/29788
Rights: This is an open access article distributed under the Creative Commons Attribution License which permits unrestricted use, distribution, and reproduction in any medium, provided the original work is properly cited.
Accession Number: edsbas.3011CCEE
Database: BASE