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Geometry for CHSNH2 (thioformamide) 1A' CS

1910171554
InChI=1S/CH3NS/c2-1-3/h1H,(H2,2,3) INChIKey=CYEBJEDOHLIWNP-UHFFFAOYSA-N

wB97X-D/LANL2DZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.6629 0.0000   0.4421 0.4940 0.0000
S2 -0.7827 -0.8344 0.0000   -1.1397 -0.0997 0.0000
N3 1.3414 0.8512 0.0000   1.5672 -0.2604 0.0000
H4 -0.5705 1.5909 0.0000   0.6359 1.5659 0.0000
H5 1.9562 0.0488 0.0000   1.4902 -1.2683 0.0000
H6 1.7476 1.7747 0.0000   2.4858 0.1568 0.0000
Atom - Atom Distances (Å)
  C1 S2 N3 H4 H5 H6
C1 1.6896 1.3546 1.0893 2.0504 2.0713
S2 1.6896 2.7116 2.4346 2.8778 3.6345
N3 1.3546 2.7116 2.0500 1.0108 1.0089
H4 1.0893 2.4346 2.0500 2.9601 2.3254
H5 2.0504 2.8778 1.0108 2.9601 1.7384
H6 2.0713 3.6345 1.0089 2.3254 1.7384
Maximum atom distance is 3.6345Å between atoms S2 and H6.
picture of thioformamide
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
S2 C1 N3 125.586
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 N3 H5 119.474 C1 N3 H6 121.732
S2 C1 H4 120.821 H5 N3 H6 118.794

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