Physico-chemical characterization, density functional theory (DFT) studies and Hirshfeld surface analysis of a new organic optical material: 1H-benzo[d]imidazol-3-ium-2,4,6-trinitrobenzene-1,3 bis(olate)
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DOI: 10.1016/j.molstruc.2017.06.022
Abstract: Abstract A novel organic crystal, 1H-benzo[ d ]imidazol-3-ium-2,4,6-trinitrobenzene-1,3 bis(olate) (BITB), was synthesized. Single crystals of BITB were harvested by solution growth-slow evaporation technique. 1 H and 13 C NMR spectroscopic techniques were utilized to confirm… read more here.
Keywords: trinitrobenzene bis; bis olate; imidazol ium; surface ... See more keywords