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Solvent Effects on IR Modes of (R)-3-Methylcyclopentanone Conformers: A Computational Investigation

โœ Scribed by Watheq Al-Basheer

Book ID
118803775
Publisher
Springer US
Year
2012
Tongue
English
Weight
500 KB
Volume
41
Category
Article
ISSN
0095-9782

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โœ Paulo R. de Oliveira; Danilo S. Ortiz; Roberto Rittner ๐Ÿ“‚ Article ๐Ÿ“… 2006 ๐Ÿ› Elsevier Science ๐ŸŒ English โš– 149 KB

NMR data, in CCl 4 , show that an increase in the concentration of cis-3-ethoxycyclohexanol (cis-3-ECH) shifts the conformational equilibrium from the ax-ax conformer (X ax-ax Z51% at 0.01 mol L K1 ), stabilized by an intramolecular hydrogen bond (IAHB), to the eq-eq conformer (X eq-eq Z67% at 0.40