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Geometry for H2O2 (Hydrogen peroxide) 1A C2

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

HF/aug-cc-pVDZ


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
O1 0.0000 0.6947 -0.0579   0.6914 0.0679 -0.0579
O2 0.0000 -0.6947 -0.0579   -0.6914 -0.0679 -0.0579
H3 0.7608 0.9039 0.4628   0.8252 0.8455 0.4628
H4 -0.7608 -0.9039 0.4628   -0.8252 -0.8455 0.4628
Atom - Atom Distances (Å)
  O1 O2 H3 H4
O1 1.3894 0.9453 1.8454
O2 1.3894 1.8454 0.9453
H3 0.9453 1.8454 2.3629
H4 1.8454 0.9453 2.3629
Maximum atom distance is 2.3629Å 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 102.784 O2 O1 H3 102.784

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