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Geometry for Al(CH3)3 (trimethyl aluminum) 1A' C3H

1910171554
InChI=1S/3CH3.Al/h3*1H3; INChIKey=JLTRXTDYQLMHGR-UHFFFAOYSA-N

CCD/6-31G*


Point group is C3h
Atom Internal Principal
x (Å) y (Å) z (Å)   a (Å) b (Å) c (Å)
Al1 0.0000 0.0000 0.0000   0.0000 0.0000 0.0000
C2 0.0000 1.9736 0.0000   1.6638 -1.0615 0.0000
C3 -1.7092 -0.9868 0.0000   -1.7512 -0.9101 0.0000
C4 1.7092 -0.9868 0.0000   0.0874 1.9716 0.0000
H5 -1.0070 2.4091 0.0000   1.4893 -2.1447 0.0000
H6 -1.5828 -2.0767 0.0000   -2.6020 -0.2174 0.0000
H7 2.5898 -0.3324 0.0000   1.1127 2.3621 0.0000
H8 0.5290 2.3739 0.8772   2.2858 -0.8309 0.8772
H9 0.5290 2.3739 -0.8772   2.2858 -0.8309 -0.8772
H10 -2.3204 -0.7288 0.8772   -1.8625 -1.5641 0.8772
H11 -2.3204 -0.7288 -0.8772   -1.8625 -1.5641 -0.8772
H12 1.7914 -1.6451 0.8772   -0.4233 2.3950 0.8772
H13 1.7914 -1.6451 -0.8772   -0.4233 2.3950 -0.8772
Atom - Atom Distances (Å)
  Al1 C2 C3 C4 H5 H6 H7 H8 H9 H10 H11 H12 H13
Al1 1.9736 1.9736 1.9736 2.6111 2.6111 2.6111 2.5855 2.5855 2.5855 2.5855 2.5855 2.5855
C2 1.9736 3.4183 3.4183 1.0972 4.3485 3.4677 1.0998 1.0998 3.6683 3.6683 4.1320 4.1320
C3 1.9736 3.4183 3.4183 3.4677 1.0972 4.3485 4.1320 4.1320 1.0998 1.0998 3.6683 3.6683
C4 1.9736 3.4183 3.4183 4.3485 3.4677 1.0972 3.6683 3.6683 4.1320 4.1320 1.0998 1.0998
H5 2.6111 1.0972 3.4677 4.3485 4.5226 4.5226 1.7692 1.7692 3.5130 3.5130 5.0037 5.0037
H6 2.6111 4.3485 1.0972 3.4677 4.5226 4.5226 5.0037 5.0037 1.7692 1.7692 3.5130 3.5130
H7 2.6111 3.4677 4.3485 1.0972 4.5226 4.5226 3.5130 3.5130 5.0037 5.0037 1.7692 1.7692
H8 2.5855 1.0998 4.1320 3.6683 1.7692 5.0037 3.5130 1.7545 4.2126 4.5633 4.2126 4.5633
H9 2.5855 1.0998 4.1320 3.6683 1.7692 5.0037 3.5130 1.7545 4.5633 4.2126 4.5633 4.2126
H10 2.5855 3.6683 1.0998 4.1320 3.5130 1.7692 5.0037 4.2126 4.5633 1.7545 4.2126 4.5633
H11 2.5855 3.6683 1.0998 4.1320 3.5130 1.7692 5.0037 4.5633 4.2126 1.7545 4.5633 4.2126
H12 2.5855 4.1320 3.6683 1.0998 5.0037 3.5130 1.7692 4.2126 4.5633 4.2126 4.5633 1.7545
H13 2.5855 4.1320 3.6683 1.0998 5.0037 3.5130 1.7692 4.5633 4.2126 4.5633 4.2126 1.7545
Maximum atom distance is 5.0037Å between atoms H5 and H12.
picture of trimethyl aluminum
Calculated Bond Angles (degrees) (Ignoring Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
C2 Al1 C3 120.000 C2 Al1 C4 120.000
C3 Al1 C4 120.000
Calculated Bond Angles (degrees) (Involving Hydrogens)
atom1 atom2 atom3 angle         atom1 atom2 atom3 angle
Al1 C2 H5 113.387 Al1 C2 H8 111.345
Al1 C2 H9 111.345 Al1 C3 H6 113.387
Al1 C3 H10 111.345 Al1 C3 H11 111.345
Al1 C4 H7 113.387 Al1 C4 H12 111.345
Al1 C4 H13 111.345 H5 C2 H8 107.276
H5 C2 H9 107.276 H6 C3 H10 107.276
H6 C3 H11 107.276 H7 C4 H12 107.276
H7 C4 H13 107.276 H8 C2 H9 105.806
H10 C3 H11 105.806 H12 C4 H13 105.806

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