An advanced treatise on physical chemistry. volume 5: molecular spectra and structure. Dielectrics and dipole moments

1955 ◽  
Vol 32 (12) ◽  
pp. 653
Author(s):  
Carsten Steffens
Keyword(s):  
Physical Chemistry ◽  
Dipole Moments ◽  
Molecular Spectra

Dipole moments of 1,2-disubstituted ethanes and their homologs: An experiment for physical chemistry

1970 ◽  
Vol 47 (4) ◽  
pp. 287 ◽  
Author(s):  
C. L. Braun ◽  
W. H. Stockmayer ◽  
R. A. Orwoll
Keyword(s):  
Physical Chemistry ◽  
Dipole Moments

Dipole moments and molecular spectra of certain derivatives of dibenzalacetone

1969 ◽  
Vol 18 (7) ◽  
pp. 1377-1380
Author(s):  
B. A. Arbuzov ◽  
L. K. Yuldasheva ◽  
I. V. Anonimova ◽  
R. R. Shagidullin ◽  
A. V. Chernova ◽  
...  
Keyword(s):  
Dipole Moments ◽  
Molecular Spectra ◽  
Derivatives Of

scholarly journals Electronic Structure and Physical-Chemistry Property Relationship for Oxazole Derivatives by Ab Initio and DFT Methods

2011 ◽  
Vol 2011 ◽  
pp. 1-7 ◽  
Author(s):  
Salah Belaidi ◽  
Malika Mellaoui
Keyword(s):  
Physical Chemistry ◽  
Electronic Structure ◽  
Ab Initio ◽  
Dipole Moments ◽  
Electron Affinities ◽  
Dft Theory ◽  
Dft Methods ◽  
Net Charges ◽  
Ab Initio And Dft ◽  
Oxazole Derivatives

The geometric, electronic structure, effect of the substitution, and structure physical-chemistry relationship for oxazoles derivatives have been studied by ab initio and DFT theory. In the present work, the calculated values, namely, net charges, bond lengths, dipole moments, electron affinities, heats of formation, and QSAR properties are reported and discussed in terms of the reactivity of oxazole derivatives.

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