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	hartrees
Energy at 0K	-360.724976
Energy at 298.15K	-360.732913
HF Energy	-360.724976
Nuclear repulsion energy	150.185819

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3246	2923	0.00
2	A'	3150	2836	0.00
3	A'	1603	1444	0.00
4	A'	1425	1283	0.00
5	A'	714	643	0.00
6	A'	540	486	0.00
7	A"	3217	2897	106.70
8	A"	1603	1443	17.27
9	A"	856	770	143.96
10	A"	201	181	17.58
11	A"	50	45	0.03
12	E'	3247	2924	59.50
12	E'	3247	2924	59.50
13	E'	3147	2833	55.04
13	E'	3147	2833	55.04
14	E'	1600	1440	5.38
14	E'	1600	1440	5.38
15	E'	1420	1278	89.05
15	E'	1420	1278	89.05
16	E'	880	792	179.86
16	E'	880	792	179.86
17	E'	686	617	33.03
17	E'	686	617	33.03
18	E'	182	164	8.19
18	E'	182	164	8.19
19	E"	3217	2897	0.00
19	E"	3217	2897	0.00
20	E"	1603	1443	0.00
20	E"	1603	1443	0.00
21	E"	691	622	0.00
21	E"	691	622	0.00
22	E"	32	29	0.00
22	E"	32	29	0.00

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	0.000
C2	0.000	1.979	0.000
C3	-1.714	-0.990	0.000
C4	1.714	-0.990	0.000
H5	-1.004	2.396	0.000
H6	-1.573	-2.068	0.000
H7	2.577	-0.328	0.000
H8	0.519	2.377	0.872
H9	0.519	2.377	-0.872
H10	-2.318	-0.739	0.872
H11	-2.318	-0.739	-0.872
H12	1.799	-1.638	0.872
H13	1.799	-1.638	-0.872

	Al1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13
Al1		1.9791	1.9791	1.9791	2.5977	2.5977	2.5977	2.5848	2.5848	2.5848	2.5848	2.5848	2.5848
C2	1.9791		3.4279	3.4279	1.0872	4.3415	3.4589	1.0903	1.0903	3.6773	3.6773	4.1332	4.1332
C3	1.9791	3.4279		3.4279	3.4589	1.0872	4.3415	4.1332	4.1332	1.0903	1.0903	3.6773	3.6773
C4	1.9791	3.4279	3.4279		4.3415	3.4589	1.0872	3.6773	3.6773	4.1332	4.1332	1.0903	1.0903
H5	2.5977	1.0872	3.4589	4.3415		4.4993	4.4993	1.7557	1.7557	3.5090	3.5090	4.9893	4.9893
H6	2.5977	4.3415	1.0872	3.4589	4.4993		4.4993	4.9893	4.9893	1.7557	1.7557	3.5090	3.5090
H7	2.5977	3.4589	4.3415	1.0872	4.4993	4.4993		3.5090	3.5090	4.9893	4.9893	1.7557	1.7557
H8	2.5848	1.0903	4.1332	3.6773	1.7557	4.9893	3.5090		1.7442	4.2146	4.5612	4.2146	4.5612
H9	2.5848	1.0903	4.1332	3.6773	1.7557	4.9893	3.5090	1.7442		4.5612	4.2146	4.5612	4.2146
H10	2.5848	3.6773	1.0903	4.1332	3.5090	1.7557	4.9893	4.2146	4.5612		1.7442	4.2146	4.5612
H11	2.5848	3.6773	1.0903	4.1332	3.5090	1.7557	4.9893	4.5612	4.2146	1.7442		4.5612	4.2146
H12	2.5848	4.1332	3.6773	1.0903	4.9893	3.5090	1.7557	4.2146	4.5612	4.2146	4.5612		1.7442
H13	2.5848	4.1332	3.6773	1.0903	4.9893	3.5090	1.7557	4.5612	4.2146	4.5612	4.2146	1.7442

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	C2	H5	112.534	Al1	C2	H8	111.414
Al1	C2	H9	111.414	Al1	C3	H6	112.534
Al1	C3	H10	111.414	Al1	C3	H11	111.414
Al1	C4	H7	112.534	Al1	C4	H12	111.414
Al1	C4	H13	111.414	C2	Al1	C3	120.000
C2	Al1	C4	120.000	C3	Al1	C4	120.000
H5	C2	H8	107.464	H5	C2	H9	107.464
H6	C3	H10	107.464	H6	C3	H11	107.464
H7	C4	H12	107.464	H7	C4	H13	107.464
H8	C2	H9	106.230	H10	C3	H11	106.230
H12	C4	H13	106.230

All results from a given calculation for Al(CH₃)₃ (trimethyl aluminum)

using model chemistry: HF/SDD

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Number	Element	Mulliken
1	Al	1.645
2	C	-1.174
3	C	-1.174
4	C	-1.174
5	H	0.208
6	H	0.208
7	H	0.208
8	H	0.209
9	H	0.209
10	H	0.209
11	H	0.209
12	H	0.209
13	H	0.209

<r²>	153.739
(<r²>)^1/2	12.399

All results from a given calculation for Al(CH3)3 (trimethyl aluminum)

using model chemistry: HF/SDD

States and conformations

All results from a given calculation for Al(CH₃)₃ (trimethyl aluminum)