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Multicenter bonding in s-block metals: An insight from theory

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Abstract Multicenter bonding, one of the common phenomenon in p-block as well as d-block metals, is a rare phenomenon in s-block metals. Very few examples, if not none, are there… Click to show full abstract

Abstract Multicenter bonding, one of the common phenomenon in p-block as well as d-block metals, is a rare phenomenon in s-block metals. Very few examples, if not none, are there in the literature. Herein, we have proposed a 3c-2e bonding scenario involving alkaline earth metals. Different bonding analyses confirm the presence of multicenter 3c-2e bonds in these proposed compounds. All these analyses are strikingly similar as found in diborane. These proposed molecules are found to be thermodynamically stable.

Keywords: multicenter; block metals; multicenter bonding; metals insight; bonding block

Journal Title: Computational and Theoretical Chemistry
Year Published: 2019

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