Find in Library
Search millions of books, articles, and more
Indexed Open Access Databases
Photoluminescent Coordination Polymers Based on Group 12 Metals and 1<i>H</i>-Indazole-6-Carboxylic Acid
oleh: Antonio A. García-Valdivia, Estitxu Echenique-Errandonea, Gloria B. Ramírez-Rodríguez, José M. Delgado-López, Belén Fernández, Sara Rojas, Javier Cepeda, Antonio Rodríguez-Diéguez
Format: | Article |
---|---|
Diterbitkan: | MDPI AG 2021-03-01 |
Deskripsi
Two new coordination polymers (CPs) based on Zn(II) and Cd(II) and 1<i>H-</i>indazole-6-carboxylic acid (H<sub>2</sub>L) of general formulae [Zn(L)(H<sub>2</sub>O)]<sub>n</sub> (<b>1</b>) and [Cd<sub>2</sub>(HL)<sub>4</sub>]<sub>n</sub> (<b>2</b>) have been synthesized and fully characterized by elemental analyses, Fourier transformed infrared spectroscopy and single crystal X-ray diffraction. The results indicate that compound <b>1</b> possesses double chains in its structure whereas <b>2</b> exhibits a 3D network. The intermolecular interactions, including hydrogen bonds, C–H···π and π···π stacking interactions, stabilize both crystal structures. Photoluminescence (PL) properties have shown that compounds <b>1</b> and <b>2</b> present similar emission spectra compared to the free-ligand. The emission spectra are also studied from the theoretical point of view by means of time-dependent density-functional theory (TD-DFT) calculations to confirm that ligand-centred <i>π-π*</i> electronic transitions govern emission of compound <b>1</b> and <b>2</b>. Finally, the PL properties are also studied in aqueous solution to explore the stability and emission capacity of the compounds.