CHIH-DFT determination of the electrical, optical, and magnetic properties and NICS aromaticity of megazol

Journal of Molecular Structure: THEOCHEM

Volumn 717, Issue 1-3, 2005, Pages 1-3

  Flores Holguín, Norma ^a   Glossman Mitnik, Daniel ^a  

^a PRINATEC Programa Institucional de Nanotecnología   (Mexico)

Author keywords

Aromaticity; Chagas disease; DFT; Megazol; Molecular structure; Polarizability; Sleeping disease

Indexed keywords

2 AMINO 5 (1 METHYL 5 NITRO 2 IMIDAZOLYL) 1,3,4 THIADIAZOLE;

AROMATIZATION; ARTICLE; CHEMICAL MODIFICATION; CHEMICAL STRUCTURE; DENSITY FUNCTIONAL THEORY; DRUG DETERMINATION; ELECTROCHEMISTRY; HYBRID; MAGNETISM; OPTICS; PHYSICAL CHEMISTRY;

EID: 14844291409     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2004.10.089     Document Type: Article

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