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Geometry for Si2H6 (disilane) 1A1g D3D

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

LSDA/3-21G


Point group is D3d
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Si1 0.0000 0.0000 1.1678   0.0000 -1.1678 0.0000
Si2 0.0000 0.0000 -1.1678   0.0000 1.1678 -0.0000
H3 0.0000 1.4154 1.6907   1.4154 -1.6907 0.0000
H4 -1.2258 -0.7077 1.6907   -0.7077 -1.6907 1.2258
H5 1.2258 -0.7077 1.6907   -0.7077 -1.6907 -1.2258
H6 0.0000 -1.4154 -1.6907   -1.4154 1.6907 -0.0000
H7 -1.2258 0.7077 -1.6907   0.7077 1.6907 1.2258
H8 1.2258 0.7077 -1.6907   0.7077 1.6907 -1.2258
Atom - Atom Distances (Å)
  Si1 Si2 H3 H4 H5 H6 H7 H8
Si1 2.3355 1.5090 1.5090 1.5090 3.1897 3.1897 3.1897
Si2 2.3355 3.1897 3.1897 3.1897 1.5090 1.5090 1.5090
H3 1.5090 3.1897 2.4516 2.4516 4.4100 3.6657 3.6657
H4 1.5090 3.1897 2.4516 2.4516 3.6657 3.6657 4.4100
H5 1.5090 3.1897 2.4516 2.4516 3.6657 4.4100 3.6657
H6 3.1897 1.5090 4.4100 3.6657 3.6657 2.4516 2.4516
H7 3.1897 1.5090 3.6657 3.6657 4.4100 2.4516 2.4516
H8 3.1897 1.5090 3.6657 4.4100 3.6657 2.4516 2.4516
Maximum atom distance is 4.4100Å between atoms H4 and H8.
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 110.277 Si1 Si2 H7 110.277
Si1 Si2 H8 110.277 Si2 Si1 H3 110.277
Si2 Si1 H4 110.277 Si2 Si1 H5 110.277
H3 Si1 H4 108.653 H3 Si1 H5 108.653
H4 Si1 H5 108.653 H6 Si2 H7 108.653
H6 Si2 H8 108.653 H7 Si2 H8 108.653

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