Study of stereospecificity of 1H, 13C, 15N and 77Se shielding constants in the configurational isomers of the selenophene-2-carbaldehyde azine by NMR spectroscopy and MP2-GIAO calculations

Magnetic Resonance in Chemistry

Volumn 49, Issue 11, 2011, Pages 740-748

  Afonin, Andrei V ^a   Pavlov, Dmitry V ^a   Albanov, Alexander I ^a   Levanova, Ekaterina P ^a   Levkovskaya, Galina G ^a  

^a A E FAVORSKY IRKUTSK INSTITUTE OF CHEMISTRY   (Russian Federation)

Author keywords

GIAO calculations; NBO analysis; NMR; Selenophene 2 carbaldehyde azine; Shielding constants; Stereospecificity

Indexed keywords

CHEMICAL SHIFT; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; PLANTS (BOTANY); SELENIUM COMPOUNDS; SHIELDING;

CARBALDEHYDES; CONFIGURATIONAL ISOMERS; ENERGY; GIAO CALCULATION; HIGH FREQUENCY HF; NBO ANALYSIS; SELENOPHENE; SELENOPHENE-2-CARBALDEHYDE AZINE; SHIELDING CONSTANTS; STEREOSPECIFICITY;

ISOMERS;

ISOTOPE; ORGANOSELENIUM DERIVATIVE; PROTON; SELENIUM; SELENOPHENE 2 CARBALDEHYDE AZINE; SELENOPHENE-2-CARBALDEHYDE AZINE;

ARTICLE; CHEMISTRY; CONFORMATION; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; QUANTUM THEORY; STEREOISOMERISM;

ISOTOPES; MAGNETIC RESONANCE SPECTROSCOPY; MOLECULAR CONFORMATION; ORGANOSELENIUM COMPOUNDS; PROTONS; QUANTUM THEORY; SELENIUM; STEREOISOMERISM;

EID: 84155162669     PISSN: 07491581     EISSN: 1097458X     Source Type: Journal    
DOI: 10.1002/mrc.2824     Document Type: Article

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