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Stabilization of the glycine zwitterionic form by complexation with Na+ and Cl−: an ab initio study

✍ Scribed by Ruslan M. Minyaev; Andrei G. Starikov; Vladimir I. Minkin


Book ID
119767813
Publisher
Royal Society of Chemistry
Year
2000
Tongue
English
Weight
110 KB
Volume
10
Category
Article
ISSN
0959-9436

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