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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

QCISD(T)=FULL/Def2TZVPP


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 0.0000 0.6381 0.0000   0.4163 0.4836 0.0000
S2 -0.7787 -0.8020 0.0000   -1.1134 -0.0998 0.0000
N3 1.3329 0.8127 0.0000   1.5403 -0.2537 0.0000
H4 -0.5437 1.5798 0.0000   0.6187 1.5519 0.0000
H5 1.9329 0.0061 0.0000   1.4688 -1.2565 0.0000
H6 1.7403 1.7291 0.0000   2.4470 0.1750 0.0000
Atom - Atom Distances (Å)
  C1 S2 N3 H4 H5 H6
C1 1.6372 1.3443 1.0873 2.0336 2.0540
S2 1.6372 2.6582 2.3934 2.8295 3.5710
N3 1.3443 2.6582 2.0273 1.0053 1.0029
H4 1.0873 2.3934 2.0273 2.9343 2.2888
H5 2.0336 2.8295 1.0053 2.9343 1.7337
H6 2.0540 3.5710 1.0029 2.2888 1.7337
Maximum atom distance is 3.5710Å 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 125.865
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C1 N3 H5 119.183 C1 N3 H6 121.431
S2 C1 H4 121.600 H5 N3 H6 119.386

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