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Theoretical predictions of cofacial bis(actinyl) complexes of a stretched Schiff-base calixpyrrole ligand†
Georg Schreckenbach,Polly L. Arnold,Jason B. Love
Chemical Communications Pub Date : 04/12/2011 00:00:00 , DOI:10.1039/C1CC10979K
Abstract

Actinyl and actinyl-transition metal complexation by a polypyrrolic macrocycle with anthracenyl linkers between the N4-donor compartments was evaluated using relativistic density functional theory which predicts that a highly unusual cofacial bis-actinyl structure complex is stable.

Graphical abstract: Theoretical predictions of cofacial bis(actinyl) complexes of a stretched Schiff-base calixpyrrole ligand
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