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Geometry for Si2H2 (disilyne) 1A1 C2V

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

CID/3-21G*


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Si1 0.0000 1.0906 -0.0515   1.0906 0.0000 -0.0515
Si2 0.0000 -1.0906 -0.0515   -1.0906 0.0000 -0.0515
H3 0.9869 0.0000 0.7205   0.0000 0.9869 0.7205
H4 -0.9869 0.0000 0.7205   0.0000 -0.9869 0.7205
Atom - Atom Distances (Å)
  Si1 Si2 H3 H4
Si1 2.1813 1.6611 1.6611
Si2 2.1813 1.6611 1.6611
H3 1.6611 1.6611 1.9738
H4 1.6611 1.6611 1.9738
Maximum atom distance is 2.1813Å 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 48.961 Si2 Si1 H3 48.961

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