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Geometry for Si2H6 (disilane) 1A1g D3D

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

M06-2X/6-311G**


Point group is D3d
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Si1 0.0000 0.0000 1.1697   0.0000 1.1697 0.0000
Si2 0.0000 0.0000 -1.1697   0.0000 -1.1697 0.0000
H3 0.0000 1.3899 1.6821   1.3899 1.6821 0.0000
H4 -1.2037 -0.6950 1.6821   -0.6950 1.6821 -1.2037
H5 1.2037 -0.6950 1.6821   -0.6950 1.6821 1.2037
H6 0.0000 -1.3899 -1.6821   -1.3899 -1.6821 0.0000
H7 -1.2037 0.6950 -1.6821   0.6950 -1.6821 -1.2037
H8 1.2037 0.6950 -1.6821   0.6950 -1.6821 1.2037
Atom - Atom Distances (Å)
  Si1 Si2 H3 H4 H5 H6 H7 H8
Si1 2.3393 1.4814 1.4814 1.4814 3.1725 3.1725 3.1725
Si2 2.3393 3.1725 3.1725 3.1725 1.4814 1.4814 1.4814
H3 1.4814 3.1725 2.4074 2.4074 4.3642 3.6401 3.6401
H4 1.4814 3.1725 2.4074 2.4074 3.6401 3.6401 4.3642
H5 1.4814 3.1725 2.4074 2.4074 3.6401 4.3642 3.6401
H6 3.1725 1.4814 4.3642 3.6401 3.6401 2.4074 2.4074
H7 3.1725 1.4814 3.6401 3.6401 4.3642 2.4074 2.4074
H8 3.1725 1.4814 3.6401 4.3642 3.6401 2.4074 2.4074
Maximum atom distance is 4.3642Å 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 110.239 Si1 Si2 H7 110.239
Si1 Si2 H8 110.239 Si2 Si1 H3 110.239
Si2 Si1 H4 110.239 Si2 Si1 H5 110.239
H3 Si1 H4 108.693 H3 Si1 H5 108.693
H4 Si1 H5 108.693 H6 Si2 H7 108.693
H6 Si2 H8 108.693 H7 Si2 H8 108.693

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