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Geometry for H2SO4 (Sulfuric acid) 1A C1

1910171554
InChI=1S/H2O4S/c1-5(2,3)4/h(H2,1,2,3,4) INChIKey=QAOWNCQODCNURD-UHFFFAOYSA-N

HF/6-31G(2df,p)


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
S1 0.0000 0.0000 0.1488   0.0000 0.0000 0.1488
O2 0.0000 1.2268 0.8097   -0.6833 -1.0189 0.8097
O3 0.0000 -1.2268 0.8097   0.6833 1.0189 0.8097
O4 1.2030 -0.0288 -0.8254   -0.9831 0.6940 -0.8254
O5 -1.2030 0.0288 -0.8254   0.9831 -0.6940 -0.8254
H6 -1.4612 -0.8500 -1.0650   1.6871 -0.1079 -1.0650
H7 1.4612 0.8500 -1.0650   -1.6871 0.1079 -1.0650
Atom - Atom Distances (Å)
  S1 O2 O3 O4 O5 H6 H7
S1 1.3935 1.3935 1.5483 1.5483 2.0812 2.0812
O2 1.3935 2.4537 2.3870 2.3572 3.1565 2.4066
O3 1.3935 2.4537 2.3572 2.3870 2.4066 3.1565
O4 1.5483 2.3870 2.3572 2.4068 2.7983 0.9468
O5 1.5483 2.3572 2.3870 2.4068 0.9468 2.7983
H6 2.0812 3.1565 2.4066 2.7983 0.9468 3.3810
H7 2.0812 2.4066 3.1565 0.9468 2.7983 3.3810
Maximum atom distance is 3.3810Å between atoms H6 and H7.
picture of Sulfuric acid
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O2 S1 O3 123.377 O2 S1 O4 108.349
O2 S1 O5 106.382 O3 S1 O4 106.382
O3 S1 O5 108.349 O4 S1 O5 102.012
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
S1 O4 H7 110.723 S1 O5 H6 110.723

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