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Geometry for H2OO (water oxide) 1A' CS

1910171554
InChI=1S/H2O2/c1-2/h1H2 INChIKey=

QCISD/3-21G*


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
O1 0.0616 -0.7104 0.0000   -0.0030 0.0615 -0.7104
O2 0.0616 0.9296 0.0000   -0.0030 0.0615 0.9296
H3 -0.4930 -0.8769 0.8048   0.8281 -0.4528 -0.8769
H4 -0.4930 -0.8769 -0.8048   -0.7796 -0.5320 -0.8769
Atom - Atom Distances (Å)
  O1 O2 H3 H4
O1 1.6400 0.9915 0.9915
O2 1.6400 2.0540 2.0540
H3 0.9915 2.0540 1.6097
H4 0.9915 2.0540 1.6097
Maximum atom distance is 2.0540Å between atoms O2 and H3.
picture of water oxide
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
O2 O1 H3 99.670 O2 O1 H4 99.670
H3 O1 H4 108.529

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