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Geometry for Si2H6 (disilane) 1A1g D3D

1910171554
InChI=1S/H6Si2/c1-2/h1-2H3 INChIKey=PZPGRFITIJYNEJ-UHFFFAOYSA-N

HF/CEP-121G*


Point group is D3d
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Si1 0.0000 0.0000 1.1866   1.1866 0.0000 0.0000
Si2 0.0000 0.0000 -1.1866   -1.1866 0.0000 0.0000
H3 0.0000 1.3981 1.7056   1.7056 1.3981 0.0000
H4 -1.2108 -0.6991 1.7056   1.7056 -0.6991 -1.2108
H5 1.2108 -0.6991 1.7056   1.7056 -0.6991 1.2108
H6 0.0000 -1.3981 -1.7056   -1.7056 -1.3981 0.0000
H7 -1.2108 0.6991 -1.7056   -1.7056 0.6991 -1.2108
H8 1.2108 0.6991 -1.7056   -1.7056 0.6991 1.2108
Atom - Atom Distances (Å)
  Si1 Si2 H3 H4 H5 H6 H7 H8
Si1 2.3732 1.4913 1.4913 1.4913 3.2124 3.2124 3.2124
Si2 2.3732 3.2124 3.2124 3.2124 1.4913 1.4913 1.4913
H3 1.4913 3.2124 2.4216 2.4216 4.4108 3.6866 3.6866
H4 1.4913 3.2124 2.4216 2.4216 3.6866 3.6865 4.4108
H5 1.4913 3.2124 2.4216 2.4216 3.6866 4.4108 3.6865
H6 3.2124 1.4913 4.4108 3.6866 3.6866 2.4216 2.4216
H7 3.2124 1.4913 3.6866 3.6865 4.4108 2.4216 2.4216
H8 3.2124 1.4913 3.6866 4.4108 3.6865 2.4216 2.4216
Maximum atom distance is 4.4108Å between atoms H3 and H6.
picture of disilane
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 H6 110.365 Si1 Si2 H7 110.365
Si1 Si2 H8 110.365 Si2 Si1 H3 110.365
Si2 Si1 H4 110.365 Si2 Si1 H5 110.365
H3 Si1 H4 108.563 H3 Si1 H5 108.563
H4 Si1 H5 108.563 H6 Si2 H7 108.563
H6 Si2 H8 108.563 H7 Si2 H8 108.563

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