Theoretical Prediction of Divalent Actinide Borozene Complexes

Naixin Zhang, Qunyan Wu, Jianhui Lan, Weiqun Shi, Congzhi Wang, Igor B Sivaev · 2024

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Description

Naixin Zhang and four co-authors predict new actinide boron complexes in a 2024 paper. A ring-shaped boron cluster bonds much like benzene and has already stabilized unusual low-valence metals. Low-valence actinide complexes are rare, so the team computed what happens when four actinide metals each sit in such a cluster. Each pairing could take a half-sandwich shape or a chair-like shape.

For three of the four metals, the sandwich form won on energy and counted as a true divalent complex. The boron ring showed a double aromatic character in those forms. Bonding analyses found strong shared-electron links that stabilize the clusters, with high energies needed to break them apart.

Catalog record

CREATORNaixin Zhang, Qunyan Wu, Jianhui Lan, Weiqun Shi, Congzhi Wang, Igor B Sivaev
YEAR2024
COLLECTIONPAPERS
FORMATTXT
FILE SIZE31 KB
VERSION1.0
LICENSECC BY 4.0
RIGHTSCC BY
SOURCEEurope PMC

Source: https://europepmc.org/articles/PMC11643500

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