Conformational analysis and stereoelectronic effects in trans-1,2-dihalocyclohexanes: 1H NMR and theoretical investigation

Spectrochimica Acta - Part A: Molecular and Biomolecular Spectroscopy

Volumn 61, Issue 8, 2005, Pages 1771-1776

  Freitas, Matheus P ^a   Rittner, Roberto ^a   Tormena, Cláudio F ^b   Abraham, Raymond J ^c  

^a UNIVERSITY OF CAMPINAS   (Brazil)

^b UNIVERSITY OF SÃO PAULO   (Brazil)

^c UNIVERSITY OF LIVERPOOL   (United Kingdom)

Author keywords

Conformational analysis; NMR; Theoretical calculations; Trans 1,2 Dihalocyclohexanes

Indexed keywords

COMPUTER SIMULATION; CONFORMATIONS; NUCLEAR MAGNETIC RESONANCE; PERMITTIVITY; REFRACTIVE INDEX; STEREOCHEMISTRY;

CONFORMATIONAL ANALYSIS; NATURAL BOND ORBITAL (NBO); THEORETICAL CALCULATIONS; TRANS-1,2-DIHALOCYCLOHEXANES;

ORGANIC COMPOUNDS;

CYCLOHEXANE DERIVATIVE; HALOGENATED HYDROCARBON;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; CONFORMATION; METHODOLOGY; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; STEREOISOMERISM; THERMODYNAMICS;

CYCLOHEXANES; HYDROCARBONS, HALOGENATED; MAGNETIC RESONANCE SPECTROSCOPY; MOLECULAR CONFORMATION; MOLECULAR STRUCTURE; STEREOISOMERISM; THERMODYNAMICS;

EID: 17844410384     PISSN: 13861425     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.saa.2004.07.007     Document Type: Article

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