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Geometry for Si2H2 (disilyne) 1A1 C2V

1910171554
InChI=1S/H4Si2/c1-2/h1-2H INChIKey=

B3PW91/aug-cc-pVDZ


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Si1 0.0000 1.1149 -0.0530   1.1149 0.0000 -0.0530
Si2 0.0000 -1.1149 -0.0530   -1.1149 0.0000 -0.0530
H3 1.0013 0.0000 0.7425   0.0000 1.0013 0.7425
H4 -1.0013 0.0000 0.7425   0.0000 -1.0013 0.7425
Atom - Atom Distances (Å)
  Si1 Si2 H3 H4
Si1 2.2298 1.6966 1.6966
Si2 2.2298 1.6966 1.6966
H3 1.6966 1.6966 2.0026
H4 1.6966 1.6966 2.0026
Maximum atom distance is 2.2298Å between atoms Si1 and Si2.
picture of disilyne
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Si1 Si2 H4 48.919 Si2 Si1 H3 48.919

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