Dipole moment derivatives and infrared intensities. I. Polar tensors

1974 ◽  
Vol 61 (3) ◽  
pp. 1040-1049 ◽  
Author(s):  
Willis B. Person ◽  
James H. Newton
Keyword(s):  
Dipole Moment ◽  
Infrared Intensities

INFRARED INTENSITIES AND BOND MOMENTS IN SULPHUR DIOXIDE

1957 ◽  
Vol 35 (8) ◽  
pp. 954-960 ◽  
Author(s):  
J. E. Mayhood
Keyword(s):  
Dipole Moment ◽  
Charge Distribution ◽  
Sulphur Dioxide ◽  
Normal Coordinate ◽  
Molecular Dipole ◽  
Molecular Dipole Moment ◽  
Equilibrium Charge ◽  
Infrared Intensities ◽  
Normal Coordinate Calculation

New values have been obtained for the intensities of the three fundamentals of sulphur dioxide. They are A1 = 317 ± 8, A2 = 376±20, A3 = 2560 ± 70, in units of 1010 sec.−1 cm.−1 at S.T.P. The normal coordinate calculation gives values for the bond moment derivatives and for the molecular dipole moment which demonstrate that the amount of charge moving in all three vibrations is greater than that inferred from the equilibrium charge distribution. The involvement of unshared electrons is suggested.

A charge–charge flux–dipole flux decomposition of the dipole moment derivatives and infrared intensities of the AB3 (A=N, P; B=H, F) molecules

2005 ◽  
Vol 317 (1) ◽  
pp. 35-42 ◽  
Author(s):  
Paulo H. César ◽  
Sérgio H.D.M. Faria ◽  
João V. da Silva ◽  
R.L.A. Haiduke ◽  
Roy E. Bruns
Keyword(s):  
Dipole Moment ◽  
Infrared Intensities ◽  
Charge Flux ◽  
A Charge
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