Department of Chemistry
Document Type
Article
Date of this Version
3-2021
Citation
White paper, released March 2021.
Abstract
This work emphasizes the need for solvent simulation as well as a counterion in calculations concerning anions, although optimization may be difficult. Solvent and counterion both play a large role in conformation of the ion. Part of the reason for the success of sulfur anions in chemical reactions may be the ability of sulfone oxygen(s) to coordinate with the counterion (usually lithium). The “solvent” partially dissociates lithium from the carbanion center.
MS Word version
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Comments
Copyright (c) 2021 Charles Kingsbury.