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Synthesis, spectroscopic (FT-IR/NMR) characterization, X-ray structure and DFT studies on (E)-2-(1-phenylethylidene) hydrazinecarboximidamide nitrate hemimethanol
(Pergamon-Elsevier Science Ltd, 2013)
The title molecular salt, (E)-2-(1-phenylethylidene) hydrazinecarboximidamide nitrate hemimethanol (C9H13N4+center dot NO3-center dot 0.5CH(4)O), was synthesized and characterized by elemental analysis, FT-IR and NMT ...
Direct and solvent-assisted thione-thiol tautomerism in 5-(thiophen-2-yl)-1,3,4-oxadiazole-2(3H)-thione: Experimental and molecular modeling study
(Elsevier, 2014)
The compound has been synthesized and characterized by IR, NMR and X-ray diffraction. Quantum chemical calculations at B3LYP/6-311++G(d,p) level were performed to study the molecular and spectroscopic properties, conformational ...
Structural and spectroscopic characterization of 2-mesityl-1H-benzo[d]imidazol-3-ium chloride: A combined experimental and theoretical analysis
(Pergamon-Elsevier Science Ltd, 2012)
The title molecular salt, 2-mesityl-1H-benzo[d]imidazol-3-ium chloride (C16H17N2+center dot Cl-), was synthesized unexpectedly from the reaction of N-[(1E)-mesitylmethylene]benzene-1.2-diamine and CoCl2 center dot 6H(2)O. ...
