c-NH2SH
 

 








Nitrogen


Nuclear Quadrupole Coupling Constants


in Thiohydroxylamine


 







 
 
   







Table 1.  Nitrogen nqcc's in c-NH2SH (MHz).  Calculation was made on the ro structure of Lovas et al. [1].
   










Calc.
Expt. [1]
   






14N Xaa 3.496 3.601(55)
Xbb - 4.946 - 4.772(64)
Xcc 1.450 1.170(71)
|Xab| 1.399
 
RMS 0.199 (6.3 %)
RSD 0.030 (1.3 %)
 
 
 
Table 2. Molecular structure parameters, ro [1] (Å and degrees).
 
NH 1.008(13)
Z-Matrix NS 1.705(3)
SH 1.351(35)
HNH 111.6(21)
HNS 112.7(9)
NSH 101.9(18)
 
 
[1] F.J.Lovas, R.D.Suenram, and W.J.Stevens, J.Mol.Spectrosc. 100,316(1983).

 








 








H2NCHO H2NCHS NH2Cl NH2F
BH2NH2 BF2NH2 PF2NH2 B2H5NH2
NH2OH
 

 








Table of Contents



Molecules/Nitrogen
 

 













NH2SH.html






Last Modified 10 Oct 2005