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Are the molecular non-covalent interactions of alkali cation-benzene (M+-XC6H5) complexes confined to a specific carbon atom or propagated through space effects of the substituents? An intense reinvestigation using LFER

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Title Are the molecular non-covalent interactions of alkali cation-benzene (M+-XC6H5) complexes confined to a specific carbon atom or propagated through space effects of the substituents? An intense reinvestigation using LFER
 
Creator Rachuru, Sanjeev
Jagannadham, V
 
Subject Hammett equation
Taft equation
Binding energies
Interaction energies
 
Description 923-927
The importance of potential use of Linear Free Energy
Relationships (LFER, both Hammett and Taft equations) is
explored by applying to the binding/interaction energies of the
cation-benzene molecular complexes. An intense study of the
application of both Hammett and Taft correlations in their various
forms in the present study reveals that the substituent effect is not
confined to a particular carbon atom of the -system of benzene but
propagated through the entire moiety of the -system. Possible
explanations are provided based on the magnitude of several
Hammett and Taft reaction constants ( and *).
 
Date 2024-09-24T12:15:24Z
2024-09-24T12:15:24Z
2024-09
 
Type Article
 
Identifier 2583-1321 (Online); 0019-5103 (Print)
http://nopr.niscpr.res.in/handle/123456789/64587
https://doi.org/10.56042/ijc.v63i9.9684
 
Language en
 
Publisher NIScPR-CSIR,India
 
Source IJC Vol.63(09) [September 2024]