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Geometry for C2H4S (Thiirane) 1A1 C2V

1910171554
InChI=1S/C2H4S/c1-2-3-1/h1-2H2 INChIKey=VOVUARRWDCVURC-UHFFFAOYSA-N

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Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
S1 0.0000 0.0000 0.8666   0.8666 0.0000 0.0000
C2 0.0000 0.7405 -0.7988   -0.7988 0.7405 0.0000
C3 0.0000 -0.7405 -0.7988   -0.7988 -0.7405 0.0000
H4 -0.9144 1.2533 -1.0700   -1.0700 1.2533 -0.9144
H5 0.9144 1.2533 -1.0700   -1.0700 1.2533 0.9144
H6 0.9144 -1.2533 -1.0700   -1.0700 -1.2533 0.9144
H7 -0.9144 -1.2533 -1.0700   -1.0700 -1.2533 -0.9144
Atom - Atom Distances (Å)
  S1 C2 C3 H4 H5 H6 H7
S1 1.8225 1.8225 2.4813 2.4813 2.4813 2.4813
C2 1.8225 1.4811 1.0829 1.0829 2.2102 2.2102
C3 1.8225 1.4811 2.2102 2.2102 1.0829 1.0829
H4 2.4813 1.0829 2.2102 1.8289 3.1028 2.5065
H5 2.4813 1.0829 2.2102 1.8289 2.5065 3.1028
H6 2.4813 2.2102 1.0829 3.1028 2.5065 1.8289
H7 2.4813 2.2102 1.0829 2.5065 3.1028 1.8289
Maximum atom distance is 3.1028Å between atoms H4 and H6.
picture of Thiirane
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
S1 C2 C3 66.026 S1 C3 C2 66.026
C2 S1 C3 47.948
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
S1 C2 H4 114.913 S1 C2 H5 114.913
S1 C3 H6 114.913 S1 C3 H7 114.913
C2 C3 H6 118.260 C2 C3 H7 118.260
C3 C2 H4 118.260 C3 C2 H5 118.260
H4 C2 H5 115.225 H6 C3 H7 115.225

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