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

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

wB97X-D/Def2TZVPP


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 1.7351 0.0000   1.7348 -0.0306 0.0000
Si3 -1.5026 -0.8675 0.0000   -0.8939 -1.4871 0.0000
Si4 1.5026 -0.8675 0.0000   -0.8409 1.5177 0.0000
H5 -1.4144 2.1814 0.0000   2.1561 -1.4527 0.0000
H6 -1.1820 -2.3156 0.0000   -2.3361 -1.1409 0.0000
H7 2.5963 0.1342 0.0000   0.1800 2.5936 0.0000
H8 0.6811 2.2760 1.1999   2.2877 0.6408 1.1999
H9 0.6811 2.2760 -1.1999   2.2877 0.6408 -1.1999
H10 -2.3116 -0.5482 1.1999   -0.5889 -2.3016 1.1999
H11 -2.3116 -0.5482 -1.1999   -0.5889 -2.3016 -1.1999
H12 1.6306 -1.7279 1.1999   -1.6988 1.6608 1.1999
H13 1.6306 -1.7279 -1.1999   -1.6988 1.6608 -1.1999
Atom - Atom Distances (Å)
  N1 Si2 Si3 Si4 H5 H6 H7 H8 H9 H10 H11 H12 H13
N1 1.7351 1.7351 1.7351 2.5998 2.5998 2.5998 2.6616 2.6616 2.6616 2.6616 2.6616 2.6616
Si2 1.7351 3.0053 3.0053 1.4831 4.2196 3.0502 1.4819 1.4819 3.4636 3.4636 4.0113 4.0113
Si3 1.7351 3.0053 3.0053 3.0502 1.4831 4.2196 4.0113 4.0113 1.4819 1.4819 3.4636 3.4636
Si4 1.7351 3.0053 3.0053 4.2196 3.0502 1.4831 3.4636 3.4636 4.0113 4.0113 1.4819 1.4819
H5 2.5998 1.4831 3.0502 4.2196 4.5030 4.5030 2.4165 2.4165 3.1137 3.1137 5.0984 5.0984
H6 2.5998 4.2196 1.4831 3.0502 4.5030 4.5030 5.0984 5.0984 2.4165 2.4165 3.1137 3.1137
H7 2.5998 3.0502 4.2196 1.4831 4.5030 4.5030 3.1137 3.1137 5.0984 5.0984 2.4165 2.4165
H8 2.6616 1.4819 4.0113 3.4636 2.4165 5.0984 3.1137 2.3997 4.1149 4.7635 4.1149 4.7635
H9 2.6616 1.4819 4.0113 3.4636 2.4165 5.0984 3.1137 2.3997 4.7635 4.1149 4.7635 4.1149
H10 2.6616 3.4636 1.4819 4.0113 3.1137 2.4165 5.0984 4.1149 4.7635 2.3997 4.1149 4.7635
H11 2.6616 3.4636 1.4819 4.0113 3.1137 2.4165 5.0984 4.7635 4.1149 2.3997 4.7635 4.1149
H12 2.6616 4.0113 3.4636 1.4819 5.0984 3.1137 2.4165 4.1149 4.7635 4.1149 4.7635 2.3997
H13 2.6616 4.0113 3.4636 1.4819 5.0984 3.1137 2.4165 4.7635 4.1149 4.7635 4.1149 2.3997
Maximum atom distance is 5.0984Å between atoms H5 and H12.
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 107.513 N1 Si2 H8 111.409
N1 Si2 H9 111.409 N1 Si3 H6 107.513
N1 Si3 H10 111.409 N1 Si3 H11 111.409
N1 Si4 H7 107.513 N1 Si4 H12 111.409
N1 Si4 H13 111.409 H5 Si2 H8 109.174
H5 Si2 H9 109.174 H6 Si3 H10 109.174
H6 Si3 H11 109.174 H7 Si4 H12 109.174
H7 Si4 H13 109.174 H8 Si2 H9 108.124
H10 Si3 H11 108.124 H12 Si4 H13 108.124

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