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Geometry for H2SeO4 (Selenic acid) 1A C2

1910171554
InChI=1S/H2O4Se/c1-5(2,3)4/h(H2,1,2,3,4) INChIKey=QYHFIVBSNOWOCQ-UHFFFAOYSA-N

HF/TZVP


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Se1 0.0000 0.0000 0.1238   0.0000 0.0000 0.1238
O2 0.0000 1.3894 0.8327   1.2254 0.6550 0.8327
O3 0.0000 -1.3894 0.8327   -1.2254 -0.6550 0.8327
O4 1.3029 0.0010 -0.9558   -0.6133 1.1496 -0.9558
O5 -1.3029 -0.0010 -0.9558   0.6133 -1.1496 -0.9558
H6 1.6125 -0.8811 -1.1208   -1.5371 1.0068 -1.1208
H7 -1.6125 0.8811 -1.1208   1.5371 -1.0068 -1.1208
Atom - Atom Distances (Å)
  Se1 O2 O3 O4 O5 H6 H7
Se1 1.5598 1.5598 1.6921 1.6921 2.2193 2.2193
O2 1.5598 2.7789 2.6123 2.6134 3.4017 2.5835
O3 1.5598 2.7789 2.6134 2.6123 2.5835 3.4017
O4 1.6921 2.6123 2.6134 2.6059 0.9492 3.0498
O5 1.6921 2.6134 2.6123 2.6059 3.0498 0.9492
H6 2.2193 3.4017 2.5835 0.9492 3.0498 3.6750
H7 2.2193 2.5835 3.4017 3.0498 0.9492 3.6750
Maximum atom distance is 3.6750Å between atoms H6 and H7.
picture of Selenic acid
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O2 Se1 O3 125.937 O2 Se1 O4 106.826
O2 Se1 O5 106.886 O3 Se1 O4 106.886
O3 Se1 O5 106.826 O4 Se1 O5 100.710
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Se1 O4 H6 111.190 Se1 O5 H7 111.190

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