MOLECULAR STRUCTURE AND QUANTUM CHEMICAL CALCULATIONS 4-ETHYL-5-(2-HYDROXYPHENYL)-1,2,4-TRIAZOL-3-THIONE
Izvestiâ Nacionalʹnoj akademii nauk Respubliki Kazahstan Seriâ himii i tehnologii（2019）
Key words
crystal structure,x-ray diffraction,1,2,4-triazole,4-ethyl-5-(2-hydroxyphenyl)-1,2,4-triazole-3-thione,quantum chemical calculations,DFT method,geometric and energy characteristics
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