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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

SVWN/6-31G*


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Se1 0.0000 0.0000 0.1273   0.0000 0.0000 0.1273
O2 0.0000 1.4359 0.8508   1.3216 -0.5615 0.8508
O3 0.0000 -1.4359 0.8508   -1.3216 0.5615 0.8508
O4 1.3431 -0.0344 -1.0033   0.4935 1.2496 -1.0033
O5 -1.3431 0.0344 -1.0033   -0.4935 -1.2496 -1.0033
H6 1.6675 -0.9643 -0.9435   -0.2354 1.9118 -0.9435
H7 -1.6675 0.9643 -0.9435   0.2354 -1.9118 -0.9435
Atom - Atom Distances (Å)
  Se1 O2 O3 O4 O5 H6 H7
Se1 1.6079 1.6079 1.7559 1.7559 2.2038 2.2038
O2 1.6079 2.8719 2.7209 2.6843 3.4294 2.4945
O3 1.6079 2.8719 2.6843 2.7209 2.4945 3.4294
O4 1.7559 2.7209 2.6843 2.6871 0.9866 3.1725
O5 1.7559 2.6843 2.7209 2.6871 3.1725 0.9866
H6 2.2038 3.4294 2.4945 0.9866 3.1725 3.8525
H7 2.2038 2.4945 3.4294 3.1725 0.9866 3.8525
Maximum atom distance is 3.8525Å 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 126.516 O2 Se1 O4 107.892
O2 Se1 O5 105.795 O3 Se1 O4 105.795
O3 Se1 O5 107.892 O4 Se1 O5 99.844
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Se1 O4 H6 103.356 Se1 O5 H7 103.356

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