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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

B3LYP/cc-pCVTZ


Point group is C2
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
S1 0.0000 0.0000 0.1583   0.0000 0.0000 0.1583
O2 0.0000 1.2561 0.8257   0.4874 1.1577 0.8257
O3 0.0000 -1.2561 0.8257   -0.4874 -1.1577 0.8257
O4 1.2397 -0.0451 -0.8455   1.1251 -0.5226 -0.8455
O5 -1.2397 0.0451 -0.8455   -1.1251 0.5226 -0.8455
H6 -1.4654 -0.8591 -1.1084   -1.6840 -0.2233 -1.1084
H7 1.4654 0.8591 -1.1084   1.6840 0.2233 -1.1084
Atom - Atom Distances (Å)
  S1 O2 O3 O4 O5 H6 H7
S1 1.4224 1.4224 1.5958 1.5958 2.1190 2.1190
O2 1.4224 2.5123 2.4542 2.4076 3.2191 2.4588
O3 1.4224 2.5123 2.4076 2.4542 2.4588 3.2191
O4 1.5958 2.4542 2.4076 2.4811 2.8372 0.9683
O5 1.5958 2.4076 2.4542 2.4811 0.9683 2.8372
H6 2.1190 3.2191 2.4588 2.8372 0.9683 3.3974
H7 2.1190 2.4588 3.2191 0.9683 2.8372 3.3974
Maximum atom distance is 3.3974Å 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 124.041 O2 S1 O4 108.667
O2 S1 O5 105.674 O3 S1 O4 105.674
O3 S1 O5 108.667 O4 S1 O5 102.042
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
S1 O4 H7 108.994 S1 O5 H6 108.994

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