Issue 20, 2011

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

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

Supplementary files

Article information

Article type
Communication
Submitted
18 Feb 2011
Accepted
24 Mar 2011
First published
12 Apr 2011

Chem. Commun., 2011,47, 5720-5722

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

Q. Pan, G. Schreckenbach, P. L. Arnold and J. B. Love, Chem. Commun., 2011, 47, 5720 DOI: 10.1039/C1CC10979K

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