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Geometry for H2S2 (Disulfane) 1A C2

1910171554
InChI=1S/H2S2/c1-2/h1-2H INChIKey=BWGNESOTFCXPMA-UHFFFAOYSA-N

wB97X-D/aug-cc-pVDZ


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
S1 0.0000 1.0438 -0.0554   1.0433 0.0329 -0.0554
S2 0.0000 -1.0438 -0.0554   -1.0433 -0.0329 -0.0554
H3 0.9576 1.2317 0.8870   1.2009 0.9960 0.8870
H4 -0.9576 -1.2317 0.8870   -1.2009 -0.9960 0.8870
Atom - Atom Distances (Å)
  S1 S2 H3 H4
S1 2.0877 1.3566 2.6426
S2 2.0877 2.6426 1.3566
H3 1.3566 2.6426 3.1203
H4 2.6426 1.3566 3.1203
Maximum atom distance is 3.1203Å between atoms H3 and H4.
picture of Disulfane
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
S1 S2 H4 97.960 S2 S1 H3 97.960

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