Understanding thio-effects in simple phosphoryl systems: role of solvent effects and nucleophile charge
Author:
Affiliation:
1. Science for Life Laboratory
2. Department of Cell and Molecular Biology
3. Uppsala University
4. Uppsala
5. Sweden
6. Biophysical Sciences Institute
7. Durham University
8. Durham DH1 3LE
9. UK
10. Department of Chemistry
Abstract
Detailed quantum chemical calculations provide insight on the origin of large differences in experimental thio-effects for the hydrolysis of (thio)phosphodichloridates by water and hydroxide nucleophiles.
Funder
European Research Council
Swedish Foundation for International Cooperation in Research and Higher Education
Publisher
Royal Society of Chemistry (RSC)
Subject
Organic Chemistry,Physical and Theoretical Chemistry,Biochemistry
Link
http://pubs.rsc.org/en/content/articlepdf/2015/OB/C5OB00309A
Reference33 articles.
1. Biological Phosphoryl-Transfer Reactions: Understanding Mechanism and Catalysis
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5. Editorial overview: Mechanisms: Chemical and computational probes of biological mechanism
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