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Geometry for H2SO3 (Sulfurous acid) 1A' CS

1910171554
InChI=1S/H2O3S/c1-4(2)3/h(H2,1,2,3) INChIKey=LSNNMFCWUKXFEE-UHFFFAOYSA-N

B2PLYP=FULL/3-21G*


Point group is Cs
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
S1 0.3003 0.3463 0.0000   0.0000 0.1080 0.4455
O2 -1.0425 0.9665 0.0000   0.0000 1.3920 -0.2887
O3 0.3003 -0.7047 1.2766   1.2766 -0.7483 -0.1641
O4 0.3003 -0.7047 -1.2766   -1.2766 -0.7483 -0.1641
H5 -0.6347 -0.9985 1.4957   1.4957 -0.4453 -1.0961
H6 -0.6347 -0.9985 -1.4957   -1.4957 -0.4453 -1.0961
Atom - Atom Distances (Å)
  S1 O2 O3 O4 H5 H6
S1 1.4790 1.6536 1.6536 2.2181 2.2181
O2 1.4790 2.4951 2.4951 2.5029 2.5029
O3 1.6536 2.4951 2.5531 1.0042 2.9404
O4 1.6536 2.4951 2.5531 2.9404 1.0042
H5 2.2181 2.5029 1.0042 2.9404 2.9914
H6 2.2181 2.5029 2.9404 1.0042 2.9914
Maximum atom distance is 2.9914Å between atoms H5 and H6.
picture of Sulfurous acid
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O2 S1 O3 105.458 O2 S1 O4 105.458
O3 S1 O4 101.067
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
S1 O3 H5 110.756 S1 O4 H6 110.756

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