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Geometry for N(SiH3)3 (trisilylamine) 1A' C3H

1910171554
InChI=1S/H9NSi3/c2-1(3)4/h2-4H3 INChIKey=

MP2/6-311+G(3df,2p)


Point group is C3h
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
N1 0.0000 0.0000 0.0000   0.0000 0.0000 0.0000
Si2 0.0000 1.7413 0.0000   1.7413 0.0124 0.0000
Si3 -1.5080 -0.8707 0.0000   -0.8599 -1.5142 0.0000
Si4 1.5080 -0.8707 0.0000   -0.8814 1.5018 0.0000
H5 -1.4134 2.1785 0.0000   2.1885 -1.3978 0.0000
H6 -1.1799 -2.3133 0.0000   -2.3048 -1.1963 0.0000
H7 2.5933 0.1348 0.0000   0.1163 2.5942 0.0000
H8 0.6797 2.2808 1.1969   2.2759 0.6960 1.1969
H9 0.6797 2.2808 -1.1969   2.2759 0.6960 -1.1969
H10 -2.3151 -0.5517 1.1969   -0.5352 -2.3189 1.1969
H11 -2.3151 -0.5517 -1.1969   -0.5352 -2.3189 -1.1969
H12 1.6353 -1.7291 1.1969   -1.7407 1.6230 1.1969
H13 1.6353 -1.7291 -1.1969   -1.7407 1.6230 -1.1969
Atom - Atom Distances (Å)
  N1 Si2 Si3 Si4 H5 H6 H7 H8 H9 H10 H11 H12 H13
N1 1.7413 1.7413 1.7413 2.5968 2.5968 2.5968 2.6639 2.6639 2.6639 2.6639 2.6639 2.6639
Si2 1.7413 3.0161 3.0161 1.4794 4.2228 3.0506 1.4784 1.4784 3.4713 3.4713 4.0188 4.0188
Si3 1.7413 3.0161 3.0161 3.0506 1.4794 4.2228 4.0188 4.0188 1.4784 1.4784 3.4713 3.4713
Si4 1.7413 3.0161 3.0161 4.2228 3.0506 1.4794 3.4713 3.4713 4.0188 4.0188 1.4784 1.4784
H5 2.5968 1.4794 3.0506 4.2228 4.4978 4.4978 2.4133 2.4133 3.1144 3.1144 5.0986 5.0986
H6 2.5968 4.2228 1.4794 3.0506 4.4978 4.4978 5.0986 5.0986 2.4133 2.4133 3.1144 3.1144
H7 2.5968 3.0506 4.2228 1.4794 4.4978 4.4978 3.1144 3.1144 5.0986 5.0986 2.4133 2.4133
H8 2.6639 1.4784 4.0188 3.4713 2.4133 5.0986 3.1144 2.3938 4.1221 4.7668 4.1221 4.7668
H9 2.6639 1.4784 4.0188 3.4713 2.4133 5.0986 3.1144 2.3938 4.7668 4.1221 4.7668 4.1221
H10 2.6639 3.4713 1.4784 4.0188 3.1144 2.4133 5.0986 4.1221 4.7668 2.3938 4.1221 4.7668
H11 2.6639 3.4713 1.4784 4.0188 3.1144 2.4133 5.0986 4.7668 4.1221 2.3938 4.7668 4.1221
H12 2.6639 4.0188 3.4713 1.4784 5.0986 3.1144 2.4133 4.1221 4.7668 4.1221 4.7668 2.3938
H13 2.6639 4.0188 3.4713 1.4784 5.0986 3.1144 2.4133 4.7668 4.1221 4.7668 4.1221 2.3938
Maximum atom distance is 5.0986Å between atoms H6 and H8.
picture of trisilylamine
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Si2 N1 Si3 120.000 Si2 N1 Si4 120.000
Si3 N1 Si4 120.000
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
N1 Si2 H5 107.185 N1 Si2 H8 111.400
N1 Si2 H9 111.400 N1 Si3 H6 107.185
N1 Si3 H10 111.400 N1 Si3 H11 111.400
N1 Si4 H7 107.185 N1 Si4 H12 111.400
N1 Si4 H13 111.400 H5 Si2 H8 109.357
H5 Si2 H9 109.357 H6 Si3 H10 109.357
H6 Si3 H11 109.357 H7 Si4 H12 109.357
H7 Si4 H13 109.357 H8 Si2 H9 108.115
H10 Si3 H11 108.115 H12 Si4 H13 108.115

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