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Geometry for HSSSH (trisulfane) 1A C2 trans

1910171554
InChI=1S/H2S3/c1-3-2/h1-2H INChIKey=KBMBVTRWEAAZEY-UHFFFAOYSA-N

MP4/6-31G*


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
S1 0.0000 0.0000 0.8470   0.8467 -0.0227 0.0000
S2 0.0000 1.6786 -0.3865   -0.3864 0.0104 1.6786
S3 0.0000 -1.6786 -0.3865   -0.3864 0.0104 -1.6786
H4 -1.3314 1.7833 -0.5915   -0.6269 -1.3150 1.7833
H5 1.3314 -1.7833 -0.5915   -0.5556 1.3467 -1.7833
Atom - Atom Distances (Å)
  S1 S2 S3 H4 H5
S1 2.0832 2.0832 2.6499 2.6499
S2 2.0832 3.3573 1.3511 3.7147
S3 2.0832 3.3573 3.7147 1.3511
H4 2.6499 1.3511 3.7147 4.4509
H5 2.6499 3.7147 1.3511 4.4509
Maximum atom distance is 4.4509Å between atoms H4 and H5.
picture of trisulfane
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
S2 S1 S3 107.378
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
S1 S2 H4 98.755 S1 S3 H5 98.755

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