Quantum chemical study of free and coordinate molecules and complexes of amides with mercuric acetate propionamide

2013

Closed access Metadata (CSL-JSON)
DOI 10.3103/s0027131413020053
Data confidence 70 medium
How this score is calculated

It is built from checkable properties of the record itself: whether the article has a DOI, how many independent sources confirmed its data, whether the required fields are filled in, and how recent the latest confirmation is. Disagreement between sources and a missing identifier lower it. A value of 80 or above means the record was published without further checking; 60 to 79 means it is published at reduced confidence, with a manual check advisable. A record verified by an editor by hand is never pushed below 90 by a recalculation. This scores our data about the article, not the article itself.

Abstract

Electron structures and reactivities of free and coordinated molecules of fatty acid amides and complex of mercury acetate with propionamide have been studied using quantum chemical methods. The geometry and energy parameters have been determined. The conformational change in the molecules of fatty acid amides and complex of mercury acetate with propionamide at complexation has been observed.