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Geometry for H2O2 (Hydrogen peroxide) 1A C2

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

QCISD(T)/cc-pVTZ


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
O1 0.0000 0.7293 -0.0576   0.7268 0.0604 -0.0576
O2 0.0000 -0.7293 -0.0576   -0.7268 -0.0604 -0.0576
H3 0.7970 0.8888 0.4610   0.8197 0.8679 0.4610
H4 -0.7970 -0.8888 0.4610   -0.8197 -0.8679 0.4610
Atom - Atom Distances (Å)
  O1 O2 H3 H4
O1 1.4585 0.9642 1.8768
O2 1.4585 1.8768 0.9642
H3 0.9642 1.8768 2.3876
H4 1.8768 0.9642 2.3876
Maximum atom distance is 2.3876Å 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 99.525 O2 O1 H3 99.525

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