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Geometry for S4 (Sulfur tetramer) 1A1 C2V

1910171554
InChI=1S/S4/c1-3-4-2 INChIKey=

B1B95/6-31+G**


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
S1 0.0000 1.0668 0.9193   0.9193 0.0000 1.0668
S2 0.0000 -1.0668 0.9193   0.9193 0.0000 -1.0668
S3 0.0000 1.5953 -0.9193   -0.9193 0.0000 1.5953
S4 0.0000 -1.5953 -0.9193   -0.9193 0.0000 -1.5953
Atom - Atom Distances (Å)
  S1 S2 S3 S4
S1 2.1336 1.9131 3.2353
S2 2.1336 3.2353 1.9131
S3 1.9131 3.2353 3.1907
S4 3.2353 1.9131 3.1907
Maximum atom distance is 3.2353Å between atoms S1 and S4.
picture of Sulfur tetramer
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
S1 S2 S4 106.039 S1 S3 S4 73.961
S2 S1 S3 106.039 S2 S4 S3 73.961

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