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Geometry for H2O2 (Hydrogen peroxide) 1A C2

1910171554
InChI=1S/H2O2/c1-2/h1-2H INChIKey=MHAJPDPJQMAIIY-UHFFFAOYSA-N

wB97X-D/CEP-31G


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
O1 0.0000 0.7464 -0.0172   0.7428 -0.0735 -0.0172
O2 0.0000 -0.7464 -0.0172   -0.7428 0.0735 -0.0172
H3 0.9558 0.9160 0.1373   1.0057 0.8610 0.1373
H4 -0.9558 -0.9160 0.1373   -1.0057 -0.8610 0.1373
Atom - Atom Distances (Å)
  O1 O2 H3 H4
O1 1.4928 0.9830 1.9238
O2 1.4928 1.9238 0.9830
H3 0.9830 1.9238 2.6478
H4 1.9238 0.9830 2.6478
Maximum atom distance is 2.6478Å between atoms H3 and H4.
picture of Hydrogen peroxide
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
O1 O2 H4 99.938 O2 O1 H3 99.938

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