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Geometry for Si2H6 (disilane) 1A1g D3D

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

HSEh1PBE/Def2TZVPP


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   1.1700 0.0000 0.0000
Si2 0.0000 0.0000 -1.1700   -1.1700 0.0000 0.0000
H3 0.0000 1.3944 1.6863   1.6863 0.4581 1.3170
H4 -1.2076 -0.6972 1.6863   1.6863 -1.3696 -0.2618
H5 1.2076 -0.6972 1.6863   1.6863 0.9115 -1.0552
H6 0.0000 -1.3944 -1.6863   -1.6863 -0.4581 -1.3170
H7 -1.2076 0.6972 -1.6863   -1.6863 -0.9115 1.0552
H8 1.2076 0.6972 -1.6863   -1.6863 1.3696 0.2618
Atom - Atom Distances (Å)
  Si1 Si2 H3 H4 H5 H6 H7 H8
Si1 2.3400 1.4869 1.4869 1.4869 3.1785 3.1785 3.1785
Si2 2.3400 3.1785 3.1785 3.1785 1.4869 1.4869 1.4869
H3 1.4869 3.1785 2.4151 2.4151 4.3762 3.6494 3.6494
H4 1.4869 3.1785 2.4151 2.4151 3.6494 3.6494 4.3762
H5 1.4869 3.1785 2.4151 2.4151 3.6494 4.3762 3.6494
H6 3.1785 1.4869 4.3762 3.6494 3.6494 2.4151 2.4151
H7 3.1785 1.4869 3.6494 3.6494 4.3762 2.4151 2.4151
H8 3.1785 1.4869 3.6494 4.3762 3.6494 2.4151 2.4151
Maximum atom distance is 4.3762Å 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 110.316 Si1 Si2 H7 110.316
Si1 Si2 H8 110.316 Si2 Si1 H3 110.316
Si2 Si1 H4 110.316 Si2 Si1 H5 110.316
H3 Si1 H4 108.614 H3 Si1 H5 108.614
H4 Si1 H5 108.614 H6 Si2 H7 108.614
H6 Si2 H8 108.614 H7 Si2 H8 108.614

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