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Substituent Effects on the Isocyano Group Infrared Frequencies and Intensities of Substituted Phenyl Isocyanides: The LFER Approach

 

作者: I.N. Juchnovski,   J.A. Tsenov,  

 

期刊: Spectroscopy Letters  (Taylor Available online 1995)
卷期: Volume 28, issue 2  

页码: 211-221

 

ISSN:0038-7010

 

年代: 1995

 

DOI:10.1080/00387019508010072

 

出版商: Taylor & Francis Group

 

关键词: IR spectra;Isocyanides;LFER;Solvent effect;Fermi-resonance.

 

数据来源: Taylor

 

摘要:

Fourier transform infrared frequencies v(N=C) and intensities A(N=C) of a series of substituted phenyl isocyanides (16 compounds) have been measured. A A-shaped relation have been found by comparison of v(N=C) (unperturbed by Fermi-resonance) with ó substituent constants: both electron-withdrawing an electron-releasing substituents cause decreases in v(N=C); this result cannot be explained simply within the LFER approach. A satisfactory (R=0.98), positive-slope A1/2(N=C) /ó correlation has been found for the substituted phenyl isocyanides, just opposite to the benzonitrile A1/2(C=N) case. The ó+constant of the isocyano group has been estimated at 0.6.

 

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