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	hartrees
Energy at 0K	-360.830221
Energy at 298.15K	-360.837885
HF Energy	-360.830221
Nuclear repulsion energy	150.771346

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3200	2901	0.00
2	A'	3124	2831	0.00
3	A'	1562	1415	0.00
4	A'	1343	1217	0.00
5	A'	631	572	0.00
6	A'	533	483	0.00
7	A"	3172	2875	85.53
8	A"	1566	1420	2.71
9	A"	758	687	99.65
10	A"	195	177	12.79
11	A"	52	47	0.12
12	E'	3201	2902	46.78
12	E'	3201	2902	46.78
13	E'	3122	2829	21.85
13	E'	3122	2829	21.85
14	E'	1560	1414	0.31
14	E'	1560	1414	0.31
15	E'	1341	1215	39.37
15	E'	1341	1215	39.37
16	E'	800	725	156.00
16	E'	800	725	156.00
17	E'	666	603	23.57
17	E'	666	603	23.57
18	E'	178	161	6.27
18	E'	178	161	6.27
19	E"	3171	2874	0.00
19	E"	3171	2874	0.00
20	E"	1565	1419	0.00
20	E"	1565	1419	0.00
21	E"	592	537	0.00
21	E"	592	537	0.00
22	E"	28	25	0.00
22	E"	28	25	0.00

Atom	x (Å)	y (Å)	z (Å)
Al1	0.000	0.000	0.000
C2	0.000	1.969	0.000
C3	-1.705	-0.985	0.000
C4	1.705	-0.985	0.000
H5	-0.998	2.397	0.000
H6	-1.577	-2.062	0.000
H7	2.575	-0.334	0.000
H8	0.524	2.361	0.870
H9	0.524	2.361	-0.870
H10	-2.306	-0.726	0.870
H11	-2.306	-0.726	-0.870
H12	1.782	-1.634	0.870
H13	1.782	-1.634	-0.870

	Al1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13
Al1		1.9692	1.9692	1.9692	2.5962	2.5962	2.5962	2.5697	2.5697	2.5697	2.5697	2.5697	2.5697
C2	1.9692		3.4107	3.4107	1.0854	4.3290	3.4547	1.0883	1.0883	3.6527	3.6527	4.1130	4.1130
C3	1.9692	3.4107		3.4107	3.4547	1.0854	4.3290	4.1130	4.1130	1.0883	1.0883	3.6527	3.6527
C4	1.9692	3.4107	3.4107		4.3290	3.4547	1.0854	3.6527	3.6527	4.1130	4.1130	1.0883	1.0883
H5	2.5962	1.0854	3.4547	4.3290		4.4967	4.4967	1.7531	1.7531	3.4963	3.4963	4.9732	4.9732
H6	2.5962	4.3290	1.0854	3.4547	4.4967		4.4967	4.9732	4.9732	1.7531	1.7531	3.4963	3.4963
H7	2.5962	3.4547	4.3290	1.0854	4.4967	4.4967		3.4963	3.4963	4.9732	4.9732	1.7531	1.7531
H8	2.5697	1.0883	4.1130	3.6527	1.7531	4.9732	3.4963		1.7398	4.1881	4.5351	4.1881	4.5351
H9	2.5697	1.0883	4.1130	3.6527	1.7531	4.9732	3.4963	1.7398		4.5351	4.1881	4.5351	4.1881
H10	2.5697	3.6527	1.0883	4.1130	3.4963	1.7531	4.9732	4.1881	4.5351		1.7398	4.1881	4.5351
H11	2.5697	3.6527	1.0883	4.1130	3.4963	1.7531	4.9732	4.5351	4.1881	1.7398		4.5351	4.1881
H12	2.5697	4.1130	3.6527	1.0883	4.9732	3.4963	1.7531	4.1881	4.5351	4.1881	4.5351		1.7398
H13	2.5697	4.1130	3.6527	1.0883	4.9732	3.4963	1.7531	4.5351	4.1881	4.5351	4.1881	1.7398

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Al1	C2	H5	113.205	Al1	C2	H8	111.074
Al1	C2	H9	111.074	Al1	C3	H6	113.205
Al1	C3	H10	111.073	Al1	C3	H11	111.073
Al1	C4	H7	113.205	Al1	C4	H12	111.074
Al1	C4	H13	111.074	C2	Al1	C3	120.000
C2	Al1	C4	120.000	C3	Al1	C4	120.000
H5	C2	H8	107.511	H5	C2	H9	107.511
H6	C3	H10	107.511	H6	C3	H11	107.511
H7	C4	H12	107.511	H7	C4	H13	107.511
H8	C2	H9	106.123	H10	C3	H11	106.123
H12	C4	H13	106.123

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

using model chemistry: HF/Def2TZVPP

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	0.863
2	C	-0.467
3	C	-0.467
4	C	-0.467
5	H	0.061
6	H	0.061
7	H	0.061
8	H	0.059
9	H	0.059
10	H	0.059
11	H	0.059
12	H	0.059
13	H	0.059

<r²>	152.130
(<r²>)^1/2	12.334

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

using model chemistry: HF/Def2TZVPP

States and conformations

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