SiS







 









Sulfur


Nuclear Quadrupole Coupling Constants


in Silicon Sulfide


 








 


 




 
   







Table 1. 33S nqcc's in SiS (MHz).
   






Calc. [a] B3LYP/6-311G(3df,3p) model.
Calc. [b] B3LYP/TZV+(3df,3p) model.
 


Calc. [a]

Calc. [b]
 Expt. [1]
   







Xzz 10.81 10.58 10.90(20)
 
 

 







Bond length, re(SiS) = 1.9293141 Å [2].
 
 

[1] J.Hoeft, F.J.Lovas, E.Tiemann, and T.Törring, J.Chem.Phys. 53,2736(1970).
[2] A. J.Hoeft, F.J.Lovas, E.Tiemann, and T.Törring, Z.Naturforsch. 24a,1422(1969).
 
 
CS GeS SiO
 

 








Table of Contents



Molecules/Sulfur

 








 













SiS.html






Last Modified 26 Sept 2004