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• W2894295707 abstract "An organic salt, 2-aminobenzimidazolium 5-nitro-2-hydroxybenzoate was synthesized and crystals were successfully grown from methanol using slow evaporation solution growth technique and recrystallization was done further to increase the purity of the crystal. The density of the grown crystals was evaluated by flotation method using carbon tetrachloride and xylene as solvents. Single crystal X-ray diffraction showed that the crystal is monoclinic system with P2 1 /n space group and molecular structure was stabilized via three dimensional hydrogen bonding interactions. For the present crystal structure, Hirshfeld surface and fingerprint plots were drawn and analysed for the intermolecular interactions. The title compound AB5N2HB was characterized by 1 H and 13 C NMR spectroscopy to predict hydrogen and carbon bonded network. FT-IR and Raman spectral studies confirmed the presence of functional groups and their modes of vibrations. In the UV–Vis absorption spectrum the band at 313 nm confirmed that the proton was transferred from cation to anion. Simultaneous thermogravimetric and differential thermal analyses revealed the thermal stability and decomposition point of compound and it was stable up to 289 °C. The synthesized compound exhibited significant anti-bacterial and anti-fungal activity against different pathogens. Among them it showed good antibacterial and anti-fungal activity against Escherichia Coli and Candida albicans when compared to standard drug Penicilin G and Ketaconazole respectively. A molecular docking interaction of compound was also studied. • A proton transfer AB5N2HB crystal was synthesized and grown by slow evaporation method. • The crystal structure was stabilized by three dimensional hydrogen bonding interactions. • NMR, FTIR, Raman, UV–Vis and TGA/DTA studies were carried out for AB5N2HB complex. • The anti-bacterial, anti-fungal activities of AB5N2HB were investigated by zone of inhibition method and the molecular docking was performed for AB5N2HB complex." @default.
• W2894295707 created "2018-10-05" @default.
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• W2894295707 date "2019-02-01" @default.
• W2894295707 modified "2023-09-26" @default.
• W2894295707 title "Structure elucidation, biological evaluation and molecular docking studies on a new organic salt: 2-Aminobenzimidazolium 5-nitro-2-hydroxybenzoate" @default.
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• W2894295707 doi "https://doi.org/10.1016/j.molstruc.2018.09.059" @default.
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