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Geometry for SO2Cl2 (Sulfuryl chloride) 1A1 C2V

1910171554
InChI=1S/Cl2O2S/c1-5(2,3)4 INChIKey=YBBRCQOCSYXUOC-UHFFFAOYSA-N

B3LYP/SDD


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
S1 0.0000 0.0000 0.6034   0.0000 0.6034 0.0000
O2 0.0000 1.3847 1.3793   0.0000 1.3793 1.3847
O3 0.0000 -1.3847 1.3793   0.0000 1.3793 -1.3847
Cl4 1.7938 0.0000 -0.9330   1.7938 -0.9330 0.0000
Cl5 -1.7938 0.0000 -0.9330   -1.7938 -0.9330 0.0000
Atom - Atom Distances (Å)
  S1 O2 O3 Cl4 Cl5
S1 1.5872 1.5872 2.3618 2.3618
O2 1.5872 2.7694 3.2375 3.2375
O3 1.5872 2.7694 3.2375 3.2375
Cl4 2.3618 3.2375 3.2375 3.5875
Cl5 2.3618 3.2375 3.2375 3.5875
Maximum atom distance is 3.5875Å between atoms Cl4 and Cl5.
picture of Sulfuryl chloride
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
O2 S1 O3 121.474 O2 S1 Cl4 108.541
O2 S1 Cl5 108.541 O3 S1 Cl4 108.541
O3 S1 Cl5 108.541 Cl4 S1 Cl5 98.838

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