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Geometry for H2S2 (Disulfane) 1A C2

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

QCISD/6-31+G**


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
S1 0.0000 1.0427 -0.0547   -0.0547 -0.0018 1.0427
S2 0.0000 -1.0427 -0.0547   -0.0547 -0.0018 -1.0427
H3 0.9418 1.2357 0.8753   0.8436 0.9703 1.2357
H4 -0.9418 -1.2357 0.8753   0.9060 -0.9123 -1.2357
Atom - Atom Distances (Å)
  S1 S2 H3 H4
S1 2.0853 1.3376 2.6349
S2 2.0853 2.6349 1.3376
H3 1.3376 2.6349 3.1074
H4 2.6349 1.3376 3.1074
Maximum atom distance is 3.1074Å 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 98.297 S2 S1 H3 98.297

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