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Geometry for Si2H6 (disilane) 1A1g D3D

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

MP2=FULL/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 1.1700   0.0000 -1.1700 0.0000
Si2 0.0000 0.0000 -1.1700   0.0000 1.1700 -0.0000
H3 0.0000 1.3856 1.6815   1.3856 -1.6815 0.0000
H4 -1.1999 -0.6928 1.6815   -0.6928 -1.6815 1.1999
H5 1.1999 -0.6928 1.6815   -0.6928 -1.6815 -1.1999
H6 0.0000 -1.3856 -1.6815   -1.3856 1.6815 -0.0000
H7 -1.1999 0.6928 -1.6815   0.6928 1.6815 1.1999
H8 1.1999 0.6928 -1.6815   0.6928 1.6815 -1.1999
Atom - Atom Distances (Å)
  Si1 Si2 H3 H4 H5 H6 H7 H8
Si1 2.3400 1.4770 1.4770 1.4770 3.1703 3.1703 3.1703
Si2 2.3400 3.1703 3.1703 3.1703 1.4770 1.4770 1.4770
H3 1.4770 3.1703 2.3999 2.3999 4.3577 3.6373 3.6373
H4 1.4770 3.1703 2.3999 2.3999 3.6373 3.6373 4.3577
H5 1.4770 3.1703 2.3999 2.3999 3.6373 4.3577 3.6373
H6 3.1703 1.4770 4.3577 3.6373 3.6373 2.3999 2.3999
H7 3.1703 1.4770 3.6373 3.6373 4.3577 2.3999 2.3999
H8 3.1703 1.4770 3.6373 4.3577 3.6373 2.3999 2.3999
Maximum atom distance is 4.3577Å 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 110.264 Si1 Si2 H7 110.264
Si1 Si2 H8 110.264 Si2 Si1 H3 110.264
Si2 Si1 H4 110.264 Si2 Si1 H5 110.264
H3 Si1 H4 108.667 H3 Si1 H5 108.667
H4 Si1 H5 108.667 H6 Si2 H7 108.667
H6 Si2 H8 108.667 H7 Si2 H8 108.667

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