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Geometry for Si3H8 (trisilane) 1A1 C2V

1910171554
InChI=1S/H8Si3/c1-3-2/h3H2,1-2H3 INChIKey=VEDJZFSRVVQBIL-UHFFFAOYSA-N

CCD/6-311G*


Point group is C2v
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Si1 0.0000 0.0000 0.8902   0.8902 0.0000 0.0000
Si2 0.0000 1.9422 -0.4188   -0.4188 0.0000 1.9422
Si3 0.0000 -1.9422 -0.4188   -0.4188 0.0000 -1.9422
H4 1.2064 0.0000 1.7699   1.7699 1.2064 0.0000
H5 -1.2064 0.0000 1.7699   1.7699 -1.2064 0.0000
H6 0.0000 3.1593 0.4401   0.4401 0.0000 3.1593
H7 0.0000 -3.1593 0.4401   0.4401 0.0000 -3.1593
H8 1.2090 1.9726 -1.2895   -1.2895 1.2090 1.9726
H9 -1.2090 1.9726 -1.2895   -1.2895 -1.2090 1.9726
H10 -1.2090 -1.9726 -1.2895   -1.2895 -1.2090 -1.9726
H11 1.2090 -1.9726 -1.2895   -1.2895 1.2090 -1.9726
Atom - Atom Distances (Å)
  Si1 Si2 Si3 H4 H5 H6 H7 H8 H9 H10 H11
Si1 2.3421 2.3421 1.4931 1.4931 3.1912 3.1912 3.1786 3.1786 3.1786 3.1786
Si2 2.3421 3.8843 3.1651 3.1651 1.4897 5.1733 1.4902 1.4902 4.1887 4.1887
Si3 2.3421 3.8843 3.1651 3.1651 5.1733 1.4897 4.1887 4.1887 1.4902 1.4902
H4 1.4931 3.1651 3.1651 2.4128 3.6339 3.6339 3.6402 4.3686 4.3686 3.6402
H5 1.4931 3.1651 3.1651 2.4128 3.6339 3.6339 4.3686 3.6402 3.6402 4.3686
H6 3.1912 1.4897 5.1733 3.6339 3.6339 6.3186 2.4210 2.4210 5.5488 5.5488
H7 3.1912 5.1733 1.4897 3.6339 3.6339 6.3186 5.5488 5.5488 2.4210 2.4210
H8 3.1786 1.4902 4.1887 3.6402 4.3686 2.4210 5.5488 2.4180 4.6272 3.9452
H9 3.1786 1.4902 4.1887 4.3686 3.6402 2.4210 5.5488 2.4180 3.9452 4.6272
H10 3.1786 4.1887 1.4902 4.3686 3.6402 5.5488 2.4210 4.6272 3.9452 2.4180
H11 3.1786 4.1887 1.4902 3.6402 4.3686 5.5488 2.4210 3.9452 4.6272 2.4180
Maximum atom distance is 6.3186Å between atoms H6 and H7.
picture of trisilane
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
S2 S1 S3 112.043
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
S1 S2 H6 110.814 S1 S2 H8 110.090
S1 S2 H9 110.090 S1 S3 H7 110.814
S1 S3 H10 110.090 S1 S3 H11 110.090
S2 S1 H4 109.226 S2 S1 H5 109.226
S3 S1 H4 109.226 S3 S1 H5 109.226
H4 S1 H5 107.799 H6 S2 H8 108.673
H6 S2 H9 108.673 H7 S3 H10 108.673
H7 S3 H11 108.673 H8 S2 H9 108.444
H10 S3 H11 108.444

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