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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/6-311+G(3df,2p)


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.6326 0.0000   -0.4342 -0.4600 0.0000
S2 -0.7628 -0.8089 0.0000   1.1100 0.0647 0.0000
N3 1.3078 0.8290 0.0000   -1.5201 0.2948 0.0000
H4 -0.5657 1.5515 0.0000   -0.6535 -1.5166 0.0000
H5 1.9239 0.0503 0.0000   -1.4337 1.2840 0.0000
H6 1.6919 1.7424 0.0000   -2.4264 -0.1058 0.0000
Atom - Atom Distances (Å)
  C1 S2 N3 H4 H5 H6
C1 1.6309 1.3224 1.0791 2.0101 2.0235
S2 1.6309 2.6401 2.3686 2.8208 3.5405
N3 1.3224 2.6401 2.0080 0.9930 0.9909
H4 1.0791 2.3686 2.0080 2.9072 2.2657
H5 2.0101 2.8208 0.9930 2.9072 1.7079
H6 2.0235 3.5405 0.9909 2.2657 1.7079
Maximum atom distance is 3.5405Å 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 126.427
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 N3 H5 119.813 C1 N3 H6 121.351
S2 C1 H4 120.494 H5 N3 H6 118.836

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