Conformational behaviour in S-methyl halothioacetates through NMR, FT-IR, and theoretical calculations

Canadian Journal of Chemistry

Volumn 82, Issue 3, 2004, Pages 418-426

  Basso, Ernani A ^a   Florin, Barbara C ^a   Tormena, Cláudio F ^b   Rittner, Roberto ^b  

^a STATE UNIVERSITY OF MARINGÁ   (Brazil)

^b UNIVERSITY OF CAMPINAS   (Brazil)

Author keywords

Conformational analysis; NMR; S methyl halothioacetates; Solvation theory; Theoretical calculations

Indexed keywords

CONFORMATIONS; FOURIER TRANSFORM INFRARED SPECTROSCOPY; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PROBABILITY DENSITY FUNCTION;

COUPLING CONSTANTS; SOLVATION; STEREO-ELECTRONIC INTERACTIONS; VAPOR PHASE ENERGY;

ORGANIC COMPOUNDS;

ACETIC ACID DERIVATIVE; S METHYLBROMOTHIOACETATE; S METHYLCHLOROTHIOACETATE; S METHYLIODOTHIOACETATE; UNCLASSIFIED DRUG;

ARTICLE; CONFORMATION; DENSITY FUNCTIONAL THEORY; ELECTRICITY; ENERGY; INFRARED SPECTROSCOPY; MATHEMATICAL COMPUTING; MOLECULAR INTERACTION; NUCLEAR MAGNETIC RESONANCE; SOLVATION; VAPOR;

EID: 2342582092     PISSN: 00084042     EISSN: None     Source Type: Journal    
DOI: 10.1139/v03-189     Document Type: Article

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