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Geometry for H2OO (water oxide) 1A' CS

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

B1B95/cc-pVTZ


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
O1 0.0596 -0.6515 0.0000   -0.0031 0.0595 -0.6515
O2 0.0596 0.8645 0.0000   -0.0031 0.0595 0.8645
H3 -0.4765 -0.8519 0.7757   0.7996 -0.4353 -0.8519
H4 -0.4765 -0.8519 -0.7757   -0.7497 -0.5165 -0.8519
Atom - Atom Distances (Å)
  O1 O2 H3 H4
O1 1.5161 0.9639 0.9639
O2 1.5161 1.9583 1.9583
H3 0.9639 1.9583 1.5514
H4 0.9639 1.9583 1.5514
Maximum atom distance is 1.9583Å 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 101.994 O2 O1 H4 101.994
H3 O1 H4 107.162

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