Abstract

Two new 2D Cd(II)-based coordination polymers (CPs), viz. [Cd2(H2L)2(2,2’-bipy)2] (1) and [Cd(L)0.5(phen)·0.5H2O] (2), have been constructed using ethylene glycol ether bridging tetracarboxylate ligand 5,5′(4,4′-phenylenebis(methyleneoxy)) diisophthalic acid (H4L). Both CPs behaved as profound fluorescent sensor for Fe3+ ion and nitro-aromatics (NACs), specifically 2,4,6-trinitrophenol (TNP). The stability at elevated temperature and photocatalytic behaviors of both 1 and 2 for photo-decomposition of aromatic dyes have also been explored. An attempt has been made to explore the plausible mechanism related with the decrease in fluorescence intensity of 1 and 2 in presence of NACs using theoretical calculations. Additionally, the probable mechanism of photo catalysis by 1 and 2 to photo-degrade aromatic dyes has been explained using density of states (DOS) calculations.

Highlights

  • The existence of traces of hazardous chemicals (HCs) inculcating both organic as well as inorganic compounds after their certain threshold limit in the environment is imposing detrimental effect on environment as well as living creatures [1,2,3,4]

  • The structures were solved by direct method (SHLEXS-2014, Sheldrick, G.M, England, UK) and refined using full-matrix least-squares procedure based on F2 (Shelxl-2014) [36]

  • The plausible mechanism related with the decline in emission intensity of coordination polymers (CPs) 1 and 2 in the presence of nitro-aromatics have been proposed with the aid of density functional theory (DFT)

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Summary

Introduction

The existence of traces of hazardous chemicals (HCs) inculcating both organic as well as inorganic compounds after their certain threshold limit in the environment is imposing detrimental effect on environment as well as living creatures [1,2,3,4]. The proper design and synthesis of porous CPs displaying multifarious molecule-based applications is highly desirable but it is still a huge challenge to chemists [30,31,32,33,34,35] Keeping these characteristics of CPs in mind and in our incessant pursuit for the designing and syntheses of new CPs that can display dual properties, i.e., as fluorescent sensor for nitro-aromatics/ions and photocatalysts for the photo-decomposition of aromatic dyes [3,4], in the presented work, we used an unexploited 5,50 -(4,40 -phenylenebis(methyleneoxy)) diisophthalic acid (H4 L) to fabricate Cd(II)-based CPs comprising of 2,20 -bipyridyl and 1,10-phenanthroline as ancillary ligand.

X-ray Crystallography
Computational Protocols
Results and Discussion
Luminescence
Photocatalysis
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