Near-IR Absorbers Based on Pt(II)-Dithiolene Donor–Acceptor Charge-Transfer (CT) Systems: A Structural Analysis to Highlight DA Interactions

Author:

Espa Davide1,Pilia Luca2ORCID,Artizzu Flavia3ORCID,Serpe Angela45ORCID,Deplano Paola14,Marchiò Luciano6ORCID

Affiliation:

1. Dipartimento di Scienze Chimiche e Geologiche, Università di Cagliari, Unità di Ricerca dell’INSTM, S.S. 554-Bivio per Sestu, 09042 Cagliari, Italy

2. Dipartimento di Ingegneria Meccanica Chimica e dei Materiali, Università di Cagliari, Via Marengo 2, 09123 Cagliari, Italy

3. Dipartimento per lo Sviluppo Sostenibile e la Transizione Ecologica (DiSSTE), Università del Piemonte Orientale “A. Avogadro”, Piazza S. Eusebio 5, 13100 Vercelli, Italy

4. Dipartimento di Ingegneria Civile, Ambientale e Architettura, INSTM Research Unit, Università di Cagliari, Via Marengo 2, 09123 Cagliari, Italy

5. Istituto di Geologia Ambientale e Geoingegneria, Consiglio Nazionale delle Ricerche (IGAG-CNR), Via Marengo 2, 09123 Cagliari, Italy

6. Dipartimento di Scienze Chimiche della Vita e della Sostenibilità Ambientale, Università di Parma, Parco Area delle Scienze 17/a, 43124 Parma, Italy

Abstract

The packing interactions of a series of electron donor (D) and electron acceptor (A) charge transfer (CT) near-IR absorbers based on platinum-dithiolene complexes are reinvestigated here as a case study also by using the Hirshfeld surface analysis. This analysis on systems, which exhibit the 1:1, 2:1 and 2:2 columnar stacking patterns between D and A, allows us to point out that several interactions of atoms and fragments are involved in the stacking interactions but also that only a limited fraction of these interactions, limited to the 1:1 D/A columnar stacking case, can be relatable to the absorption features of this class of compounds.

Publisher

MDPI AG

Subject

Chemistry (miscellaneous),Analytical Chemistry,Organic Chemistry,Physical and Theoretical Chemistry,Molecular Medicine,Drug Discovery,Pharmaceutical Science

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