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	hartrees
Energy at 0K	-156.762666
Energy at 298.15K	-156.770543
HF Energy	-156.127374
Nuclear repulsion energy	119.755213

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3239	3018	9.41
2	A₁	3220	3000	23.69
3	A₁	3116	2903	34.56
4	A₁	1776	1655	12.47
5	A₁	1559	1452	11.67
6	A₁	1500	1397	0.52
7	A₁	1467	1367	0.14
8	A₁	1118	1041	1.92
9	A₁	841	783	0.12
10	A₁	383	357	0.11
11	A₂	3180	2962	0.00
12	A₂	1523	1418	0.00
13	A₂	1046	974	0.00
14	A₂	714	665	0.00
15	A₂	163	151	0.00
16	B₁	3181	2964	43.30
17	B₁	1538	1433	16.37
18	B₁	1133	1055	1.85
19	B₁	899	837	54.76
20	B₁	416	387	7.01
21	B₁	202	188	0.75
22	B₂	3327	3100	19.75
23	B₂	3219	2998	24.97
24	B₂	3113	2900	23.63
25	B₂	1543	1438	4.56
26	B₂	1471	1371	9.21
27	B₂	1346	1254	2.01
28	B₂	1015	946	0.18
29	B₂	997	929	0.02
30	B₂	440	410	1.39

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.112
C2	0.000	0.000	1.453
H3	0.000	0.919	2.020
H4	0.000	-0.919	2.020
C5	0.000	1.288	-0.676
C6	0.000	-1.288	-0.676
H7	0.000	2.149	-0.015
H8	0.876	1.345	-1.322
H9	-0.876	1.345	-1.322
H10	0.000	-2.149	-0.015
H11	-0.876	-1.345	-1.322
H12	0.876	-1.345	-1.322

	C1	C2	H3	H4	C5	C6	H7	H8	H9	H10	H11	H12
C1		1.3406	2.1178	2.1178	1.5102	1.5102	2.1531	2.1524	2.1524	2.1531	2.1524	2.1524
C2	1.3406		1.0801	1.0801	2.4884	2.4884	2.6028	3.2053	3.2053	2.6028	3.2053	3.2053
H3	2.1178	1.0801		1.8381	2.7216	3.4846	2.3782	3.4809	3.4809	3.6820	4.1305	4.1305
H4	2.1178	1.0801	1.8381		3.4846	2.7216	3.6820	4.1305	4.1305	2.3782	3.4809	3.4809
C5	1.5102	2.4884	2.7216	3.4846		2.5761	1.0858	1.0897	1.0897	3.5004	2.8491	2.8491
C6	1.5102	2.4884	3.4846	2.7216	2.5761		3.5004	2.8491	2.8491	1.0858	1.0897	1.0897
H7	2.1531	2.6028	2.3782	3.6820	1.0858	3.5004		1.7668	1.7668	4.2987	3.8322	3.8322
H8	2.1524	3.2053	3.4809	4.1305	1.0897	2.8491	1.7668		1.7524	3.8322	3.2105	2.6901
H9	2.1524	3.2053	3.4809	4.1305	1.0897	2.8491	1.7668	1.7524		3.8322	2.6901	3.2105
H10	2.1531	2.6028	3.6820	2.3782	3.5004	1.0858	4.2987	3.8322	3.8322		1.7668	1.7668
H11	2.1524	3.2053	4.1305	3.4809	2.8491	1.0897	3.8322	3.2105	2.6901	1.7668		1.7524
H12	2.1524	3.2053	4.1305	3.4809	2.8491	1.0897	3.8322	2.6901	3.2105	1.7668	1.7524

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H3	121.689	C1	C2	H4	121.689
C1	C5	H7	111.016	C1	C5	H8	110.719
C1	C5	H9	110.719	C1	C6	H10	111.016
C1	C6	H11	110.719	C1	C6	H12	110.719
C2	C1	C5	121.473	C2	C1	C6	121.473
H3	C2	H4	116.622	C5	C1	C6	117.054
H7	C5	H8	108.611	H7	C5	H9	108.611
H8	C5	H9	107.042	H10	C6	H11	108.611
H10	C6	H12	108.611	H11	C6	H12	107.042

All results from a given calculation for CH₂C(CH₃)CH₃ (1-Propene, 2-methyl-)

using model chemistry: MP3=FULL/6-31+G**

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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All results from a given calculation for CH2C(CH3)CH3 (1-Propene, 2-methyl-)

using model chemistry: MP3=FULL/6-31+G**

States and conformations

All results from a given calculation for CH₂C(CH₃)CH₃ (1-Propene, 2-methyl-)