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Geometry for SeCl2 (Selenium Dichloride) 1A1 C2V

1910171554
InChI=1S/Cl2Se/c1-3-2 INChIKey=SWAKCLHCWHYEOW-UHFFFAOYSA-N

B3LYPultrafine/aug-cc-pVTZ


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Se1 0.0000 0.0000 0.6866   0.6866 0.0000 0.0000
Cl2 0.0000 1.6945 -0.6866   -0.6866 0.0000 1.6945
Cl3 0.0000 -1.6945 -0.6866   -0.6866 0.0000 -1.6945
Atom - Atom Distances (Å)
  Se1 Cl2 Cl3
Se1 2.1811 2.1811
Cl2 2.1811 3.3891
Cl3 2.1811 3.3891
Maximum atom distance is 3.3891Å between atoms Cl2 and Cl3.
picture of Selenium Dichloride
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Cl2 Se1 Cl3 101.958

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