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Geometry for H2O2 (Hydrogen peroxide) 1A C2

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

CCSD=FULL/6-31G(2df,p)


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
O1 0.0000 0.7118 -0.0594   0.7092 0.0601 -0.0594
O2 0.0000 -0.7118 -0.0594   -0.7092 -0.0601 -0.0594
H3 0.7761 0.8969 0.4750   0.8282 0.8490 0.4750
H4 -0.7761 -0.8969 0.4750   -0.8282 -0.8490 0.4750
Atom - Atom Distances (Å)
  O1 O2 H3 H4
O1 1.4236 0.9603 1.8643
O2 1.4236 1.8643 0.9603
H3 0.9603 1.8643 2.3721
H4 1.8643 0.9603 2.3721
Maximum atom distance is 2.3721Å 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 101.114 O2 O1 H3 101.114

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