Hydrothermal preparation, crystal structure, Hirshfeld surface analysis, photophysical properties and antifungal activity of a series of complexes assembled by 5-bromo-2-(carboxymethoxy)benzoic acid ligands

•Five complexes were designed and synthesized with H2BCBA ligand by solvothermal condition.•All of the complexes 1–5 have been structurally characterized by infrared spectra (IR), elemental analyses, single-crystal X-ray diffraction analyses and thermogravimetric analyses (TGA).•The reciprocal H…O/H...

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Veröffentlicht in:Journal of molecular structure 2024-09, Vol.1312, p.138593, Article 138593
Hauptverfasser: Xiong, Xin-Ting, Yi, Xiu-Guang, Xiao, Pan-Lei, Peng, Da-Yong, Xiong, Zhi-Qiang, Nie, Xu-Liang
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Sprache:eng
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Zusammenfassung:•Five complexes were designed and synthesized with H2BCBA ligand by solvothermal condition.•All of the complexes 1–5 have been structurally characterized by infrared spectra (IR), elemental analyses, single-crystal X-ray diffraction analyses and thermogravimetric analyses (TGA).•The reciprocal H…O/H/Br/C contacts dominate over 86 % of total Hirshfeld surface.•Photo-luminescence properties and Solid-state UV–Vis diffuse reflectance spectroscopy of complexes 1–5 were investigated.•Antifungal activity for complexes 1–5 were investigated. Five complexes [Co(BCBA)(H2O)3]n (1), [Co(BCBA)(4,4′-Bipy)2·(H2O)]n (2), [Cu(BCBA)(H2O)]n (3), [Zn(BCBA)(H2O)]n (4) and [Cd(BCBA)(2,2′-Bipy)(H2O)·(H2O)]n (5) (H2BCBA= 5‑bromo-2-(carboxymethoxy)benzoic acid, 4,4′-Bipy = 4,4′-bipyridine and 2,2′-Bipy = 2,2′-bipyridine) have been synthesized with H2BCBA ligand by solvothermal condition. All the complexes have been structurally characterized by infrared spectra (IR), elemental analyses and single-crystal X-ray diffraction analyses. Complex 1 is a zero-dimensional structure, and complexes 2–5 are one-dimensional chain structure. Furthermore, thermogravimetric analyses (TGA), Hirshfeld surface analysis, photo-luminescence properties, Solid-state UV–Vis diffuse reflectance spectroscopy and antifungal activity for complexes 1–5 were investigated. The reciprocal H···O/H/Br/C contacts dominate over 86 % of total Hirshfeld surface. Complexes 1–5 have certain inhibitory effects on 8 pathogenic fungi. Among them, complex 5 has the strongest antibacterial activity against Rhizoctonia solani AG1, Sphaeropsis sapinea and Colletotrichum fructicola, and the inhibitory rate reached 100 %. Five complexes were synthesized and structurally characterized. The reciprocal H…O/H/Br/C contacts dominate over 86 % of total Hirshfeld surface. Photo-luminescence properties and Solid-state UV–Vis diffuse reflectance spectroscopy were investigated. Complex 5 has the strongest antibacterial activity and the inhibitory rate reached 100 %. [Display omitted]
ISSN:0022-2860
1872-8014
DOI:10.1016/j.molstruc.2024.138593