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Self-assembly and supramolecular isomerism in copper (II) coordination compounds of pyridine-4-carboxamide based ligand

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Abstract Supramolecular isomerism and structural transformations have been studied for four coordination compounds of Cu(II) with L as N, N-diisopropylisonicotinamide. Three different compounds [Cu(L)2(NO3)2(H2O)1.5] (1), [Cu(L)2(NO3)2]n (2) and [Cu(L)(NO3)2]n (3)… Click to show full abstract

Abstract Supramolecular isomerism and structural transformations have been studied for four coordination compounds of Cu(II) with L as N, N-diisopropylisonicotinamide. Three different compounds [Cu(L)2(NO3)2(H2O)1.5] (1), [Cu(L)2(NO3)2]n (2) and [Cu(L)(NO3)2]n (3) were synthesized from the same reactants having metal-to-ligand ratio of 1:1 or 3:1, under different reaction conditions. 1 is a simple coordination compound while 2 and 3 are 1D coordination polymers (CPs). 1 shows a thermally induced, irreversible single crystal to single crystal phase transformation to 2, which is confirmed by Powder X-ray diffraction (PXRD), Thermo gravimetric analysis (TGA) and differential scanning calorimeteric (DSC) analysis. In the presence of KBr, 3 shows, a rare, metal bound anion exchange which induces structural transformation to a new CP, [Cu(L)2(Br)2]n (4). Attempts for a reverse anion induced transformation of 4, in the presence of KNO3, gives 1 instead of 3. Crystal structures of all the four compounds have been solved. Hirshfeld surface analyses were performed to visualize and highlight the differences in supramolecular interactions between the single-crystal-to-single-crystal (SCSC) transformed products 1 and 2. Further Compound 1 and 2 are used in the synthesis of CuO nanoparticles.

Keywords: single crystal; coordination; self assembly; supramolecular isomerism; coordination compounds

Journal Title: Inorganica Chimica Acta
Year Published: 2019

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