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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

HF/6-31G(2df,p)


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.6343 0.0000   -0.4229 -0.4727 0.0000
S2 -0.7624 -0.8118 0.0000   1.1094 0.0967 0.0000
N3 1.3071 0.8327 0.0000   -1.5294 0.2509 0.0000
H4 -0.5662 1.5551 0.0000   -0.6149 -1.5365 0.0000
H5 1.9218 0.0523 0.0000   -1.4671 1.2424 0.0000
H6 1.6925 1.7461 0.0000   -2.4256 -0.1728 0.0000
Atom - Atom Distances (Å)
  C1 S2 N3 H4 H5 H6
C1 1.6348 1.3221 1.0809 2.0080 2.0250
S2 1.6348 2.6434 2.3750 2.8199 3.5453
N3 1.3221 2.6434 2.0077 0.9935 0.9913
H4 1.0809 2.3750 2.0077 2.9066 2.2667
H5 2.0080 2.8199 0.9935 2.9066 1.7093
H6 2.0250 3.5453 0.9913 2.2667 1.7093
Maximum atom distance is 3.5453Å 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 126.430
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 N3 H5 119.593 C1 N3 H6 121.510
S2 C1 H4 120.616 H5 N3 H6 118.897

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