Abstract

The complex [Dy(L)(tta)3] with L the chiral 3-(2-pyridyl)-4-aza[6]-helicene ligand (tta− = 2-thenoyltrifluoroaacetonate) has been synthesized in its racemic form and structurally and magnetically characterized. [Dy(L)(tta)3] behaves as a single molecule magnet in its crystalline phase with the opening of a hysteresis loop at 0.50 K. These magnetic properties were interpreted with ab initio calculations.

Highlights

  • The design of single molecule magnet (SMM), with the aim of enhancing its peculiar magnetic properties, has been a prolific field in the scientific community for decades [1,2,3]

  • The N2O6 coordination polyhedron can be described as a distorted square antiprism environment (D4d symmetry on the basis of SHAPE analysis, Table S2) [41]

  • In the course of intermixing chirality offered by the nature of the ligands and SMM properties, we extend the family of [6]-helicene-based lanthanide SMM [27]

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Summary

Introduction

The design of single molecule magnet (SMM), with the aim of enhancing its peculiar magnetic properties, has been a prolific field in the scientific community for decades [1,2,3]. Lanthanides have been intensively studied for their peculiar luminescence that covers a broad range of frequencies (from visible to near IR) with sharp line shape emission bands and long lifetime of the excited states [16,17,18,19,20,21,22]. They show very low absorption coefficients, since the f–f transitions are prohibited (Laporte rule) [23]. We report the synthesis, the single crystal X-ray structural analysis and the magnetic characterization along with extensive ab initio calculations of the novel compound [Dy(L)(tta)3] (1)

Structure
Magnetic Properties
Physical Measurements
Computational Details
Conclusions
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