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Crystal engineering of non-centrosymmetric systems

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Crystal engineering of non-centrosymmetric systems

Giordana A.1, Priola E.1, Bonometti E.1, Operti L.1, Diana E.1

1

University of Turin, Department of Chemistry, Via P. Giuria 7, 10125 Turin, Italy,

e-mail: alegiordana@gmail.com

Organometallic crystals lacking of inversion center were synthesized starting from acentric reagents following two different approaches: asymmetric metal center or asymmetric ligand.

The former is a mixed halide of mercury (II), HgBrI, crystallizing in the space group Cmc2(1) [1], which was prepared by a completely new solid state reaction. The latter is 2-(2’-pyridyl)-1,8-napthyridine (pyNP) whose crystalline structure was first determined by our research group and results in space group P2(1).

A series of organometallic compounds were synthesized and their crystalline structure verified by single crystal X-ray diffraction, Raman, IR and UV-VIS electronic spectroscopes. Complexes with mixed salt and aromatic heterocyclic ligands drift to a non-centrosymmetry crystalline structure while those with pyNP tend to be centrosymmetic. From results obtaining we deduced the crystalline packing was mainly influenced by metal center respect to ligand. Crystals of mixed salt have a structural disorder due to Iodide-Bromide VICARIANZA facilitating non-centrosymmetry.

These systems could present NLO properties and could be employed in optical and optoelectronic application. [2]

[1] Wu Q., Li Y., Chen H. et al., Inorg. Chem. Comm. 34 (2013) 1. [2] Long N. J. , Angew.Chem. Int. Ed. Engl., 34 (1995) 21

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