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	hartrees
Energy at 0K	-360.780543
Energy at 298.15K	-360.788203
HF Energy	-360.780543
Nuclear repulsion energy	150.655088

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3212	2909	0.00
2	A'	3131	2835	0.00
3	A'	1567	1419	0.00
4	A'	1356	1228	0.00
5	A'	631	571	0.00
6	A'	536	485	0.00
7	A"	3185	2884	80.01
8	A"	1573	1425	1.36
9	A"	763	691	110.15
10	A"	197	178	11.14
11	A"	49	44	0.08
12	E'	3214	2910	43.81
12	E'	3214	2910	43.81
13	E'	3129	2833	16.93
13	E'	3129	2833	16.93
14	E'	1566	1418	0.09
14	E'	1566	1418	0.09
15	E'	1353	1225	29.44
15	E'	1353	1225	29.44
16	E'	803	727	162.04
16	E'	803	727	162.04
17	E'	668	605	17.90
17	E'	668	605	17.90
18	E'	179	162	5.09
18	E'	179	162	5.09
19	E"	3184	2883	0.00
19	E"	3184	2883	0.00
20	E"	1571	1423	0.00
20	E"	1571	1423	0.00
21	E"	594	538	0.00
21	E"	594	538	0.00
22	E"	25	22	0.00
22	E"	25	22	0.00

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	0.000
C2	0.000	1.970	0.000
C3	-1.706	-0.985	0.000
C4	1.706	-0.985	0.000
H5	-0.997	2.405	0.000
H6	-1.584	-2.066	0.000
H7	2.581	-0.339	0.000
H8	0.527	2.362	0.871
H9	0.527	2.362	-0.871
H10	-2.309	-0.725	0.871
H11	-2.309	-0.725	-0.871
H12	1.782	-1.637	0.871
H13	1.782	-1.637	-0.871

	Al1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13
Al1		1.9704	1.9704	1.9704	2.6033	2.6033	2.6033	2.5720	2.5720	2.5720	2.5720	2.5720	2.5720
C2	1.9704		3.4129	3.4129	1.0874	4.3360	3.4636	1.0904	1.0904	3.6544	3.6544	4.1170	4.1170
C3	1.9704	3.4129		3.4129	3.4636	1.0874	4.3360	4.1170	4.1170	1.0904	1.0904	3.6544	3.6544
C4	1.9704	3.4129	3.4129		4.3360	3.4636	1.0874	3.6544	3.6544	4.1170	4.1170	1.0904	1.0904
H5	2.6033	1.0874	3.4636	4.3360		4.5091	4.5091	1.7553	1.7553	3.5037	3.5037	4.9820	4.9820
H6	2.6033	4.3360	1.0874	3.4636	4.5091		4.5091	4.9820	4.9820	1.7553	1.7553	3.5037	3.5037
H7	2.6033	3.4636	4.3360	1.0874	4.5091	4.5091		3.5037	3.5037	4.9820	4.9820	1.7553	1.7553
H8	2.5720	1.0904	4.1170	3.6544	1.7553	4.9820	3.5037		1.7415	4.1918	4.5391	4.1918	4.5391
H9	2.5720	1.0904	4.1170	3.6544	1.7553	4.9820	3.5037	1.7415		4.5391	4.1918	4.5391	4.1918
H10	2.5720	3.6544	1.0904	4.1170	3.5037	1.7553	4.9820	4.1918	4.5391		1.7415	4.1918	4.5391
H11	2.5720	3.6544	1.0904	4.1170	3.5037	1.7553	4.9820	4.5391	4.1918	1.7415		4.5391	4.1918
H12	2.5720	4.1170	3.6544	1.0904	4.9820	3.5037	1.7553	4.1918	4.5391	4.1918	4.5391		1.7415
H13	2.5720	4.1170	3.6544	1.0904	4.9820	3.5037	1.7553	4.5391	4.1918	4.5391	4.1918	1.7415

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	C2	H5	113.551	Al1	C2	H8	111.053
Al1	C2	H9	111.053	Al1	C3	H6	113.551
Al1	C3	H10	111.053	Al1	C3	H11	111.053
Al1	C4	H7	113.551	Al1	C4	H12	111.053
Al1	C4	H13	111.053	C2	Al1	C3	120.000
C2	Al1	C4	120.000	C3	Al1	C4	120.000
H5	C2	H8	107.411	H5	C2	H9	107.411
H6	C3	H10	107.411	H6	C3	H11	107.411
H7	C4	H12	107.411	H7	C4	H13	107.411
H8	C2	H9	105.982	H10	C3	H11	105.982
H12	C4	H13	105.982

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

using model chemistry: HF/6-31G(2df,p)

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	0.724
2	C	-0.655
3	C	-0.655
4	C	-0.655
5	H	0.140
6	H	0.140
7	H	0.140
8	H	0.137
9	H	0.137
10	H	0.137
11	H	0.137
12	H	0.137
13	H	0.137

<r²>	151.829
(<r²>)^1/2	12.322

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

using model chemistry: HF/6-31G(2df,p)

States and conformations

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