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Geometry for CH3S (thiomethoxy) 2A' C3V

1910171554
InChI=1S/CH3S/c1-2/h1H3 INChIKey=QSLPNSWXUQHVLP-UHFFFAOYSA-N

HF/6-311G*


Point group is C1
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
C1 1.1130 0.0000 -0.0056   1.1130 0.0000 -0.0048
S2 -0.6944 0.0000 -0.0015   -0.6944 0.0000 -0.0020
H3 1.4361 -0.0010 1.0291   1.4353 -0.0010 1.0302
H4 1.4984 -0.8869 -0.4868   1.4988 -0.8869 -0.4857
H5 1.4985 0.8878 -0.4852   1.4989 0.8878 -0.4840
Atom - Atom Distances (Å)
  C1 S2 H3 H4 H5
C1 1.8074 1.0840 1.0802 1.0802
S2 1.8074 2.3667 2.4147 2.4148
H3 1.0840 2.3667 1.7569 1.7570
H4 1.0802 2.4147 1.7569 1.7748
H5 1.0802 2.4148 1.7570 1.7748
Maximum atom distance is 2.4148Å between atoms S2 and H5.
picture of thiomethoxy
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
S2 C1 H3 107.209 S2 C1 H4 110.969
S2 C1 H5 110.975 H3 C1 H4 108.547
H3 C1 H5 108.551 H4 C1 H5 110.471

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