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Modeling Surface Engineering: Use of Polymetallic Iron Cages and Computer Graphics To Understand the Mode of Action of a Corrosion Inhibitor
Author(s) -
Frey Marcus,
Harris Steven G.,
Holmes Jeremy M.,
Nation David A.,
Parsons Simon,
Tasker Peter A.,
Teat Simon J.,
Winpenny Richard E. P.
Publication year - 1998
Publication title -
angewandte chemie international edition
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 5.831
H-Index - 550
eISSN - 1521-3773
pISSN - 1433-7851
DOI - 10.1002/(sici)1521-3773(19981217)37:23<3245::aid-anie3245>3.0.co;2-f
Subject(s) - carboxylate , corrosion , corrosion inhibitor , hydrogen bond , hydroxide , molecule , overlayer , group (periodic table) , metal , materials science , surface (topology) , chemistry , chemical engineering , polymer chemistry , inorganic chemistry , stereochemistry , organic chemistry , metallurgy , engineering , mathematics , geometry
Simple organic molecules can have many functions. The active ingredient in the corrosion inhibitor 3‐(4‐methylbenzoyl)propionate works because it addresses the metal sites of a surface through carboxylate groups, forms hydrogen bonds with surface hydroxide groups (see picture), and provides excellent surface coverage through efficient packing of substituted aromatic groups.

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