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Geometry for NH2SH (Thiohydroxylamine) 1A' CS trans

1910171554
InChI=1S/H3NS/c1-2/h2H,1H2 INChIKey=

QCISD(T)/cc-pVTZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0126 1.1188 0.0000   1.1145 0.0994 0.0000
S2 0.0126 -0.6206 0.0000   -0.6197 -0.0357 0.0000
H3 -1.3224 -0.7722 0.0000   -0.6672 -1.3783 0.0000
H4 0.5168 1.4352 0.8187   1.3908 0.6267 0.8187
H5 0.5168 1.4352 -0.8187   1.3908 0.6267 -0.8187
Atom - Atom Distances (Å)
  N1 S2 H3 H4 H5
N1 1.7394 2.3147 1.0122 1.0122
S2 1.7394 1.3435 2.2696 2.2696
H3 2.3147 1.3435 2.9875 2.9875
H4 1.0122 2.2696 2.9875 1.6374
H5 1.0122 2.2696 2.9875 1.6374
Maximum atom distance is 2.9875Å between atoms H3 and H4.
picture of Thiohydroxylamine
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
N1 S2 H3 96.479 S2 N1 H4 108.215
S2 N1 H5 108.215 H4 N1 H5 107.962

For information on specific bond angles or dihedrals see the geometry comparison page in section Comparisons > Geometry > Bonds, angles.