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	hartrees
Energy at 0K	-156.151627
Energy at 298.15K	-156.159769
Nuclear repulsion energy	120.149139

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3277	2978	12.14
2	A₁	3244	2947	28.82
3	A₁	3156	2867	54.71
4	A₁	1860	1690	25.85
5	A₁	1619	1471	13.24
6	A₁	1563	1420	0.28
7	A₁	1529	1389	0.16
8	A₁	1172	1065	2.04
9	A₁	857	779	0.04
10	A₁	403	366	0.33
11	A₂	3193	2901	0.00
12	A₂	1589	1444	0.00
13	A₂	1105	1004	0.00
14	A₂	765	695	0.00
15	A₂	173	157	0.00
16	B₁	3199	2906	80.07
17	B₁	1607	1460	16.43
18	B₁	1204	1094	0.03
19	B₁	1039	943	53.29
20	B₁	477	433	8.58
21	B₁	221	201	0.32
22	B₂	3354	3047	26.18
23	B₂	3242	2945	36.31
24	B₂	3149	2861	23.56
25	B₂	1601	1455	4.38
26	B₂	1538	1397	6.45
27	B₂	1396	1268	3.32
28	B₂	1058	961	0.20
29	B₂	1033	939	0.06
30	B₂	471	428	1.60

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.128
C2	0.000	0.000	1.448
H3	0.000	0.917	2.013
H4	0.000	-0.917	2.013
C5	0.000	1.275	-0.676
C6	0.000	-1.275	-0.676
H7	0.000	2.151	-0.039
H8	0.875	1.321	-1.322
H9	-0.875	1.321	-1.322
H10	0.000	-2.151	-0.039
H11	-0.875	-1.321	-1.322
H12	0.875	-1.321	-1.322

	C1	C2	H3	H4	C5	C6	H7	H8	H9	H10	H11	H12
C1		1.3204	2.0964	2.0964	1.5074	1.5074	2.1577	2.1471	2.1471	2.1577	2.1471	2.1471
C2	1.3204		1.0767	1.0767	2.4777	2.4777	2.6152	3.1908	3.1908	2.6152	3.1908	3.1908
H3	2.0964	1.0767		1.8330	2.7133	3.4693	2.3949	3.4713	3.4713	3.6908	4.1099	4.1099
H4	2.0964	1.0767	1.8330		3.4693	2.7133	3.6908	4.1099	4.1099	2.3949	3.4713	3.4713
C5	1.5074	2.4777	2.7133	3.4693		2.5501	1.0835	1.0879	1.0879	3.4851	2.8141	2.8141
C6	1.5074	2.4777	3.4693	2.7133	2.5501		3.4851	2.8141	2.8141	1.0835	1.0879	1.0879
H7	2.1577	2.6152	2.3949	3.6908	1.0835	3.4851		1.7608	1.7608	4.3025	3.8033	3.8033
H8	2.1471	3.1908	3.4713	4.1099	1.0879	2.8141	1.7608		1.7492	3.8033	3.1681	2.6414
H9	2.1471	3.1908	3.4713	4.1099	1.0879	2.8141	1.7608	1.7492		3.8033	2.6414	3.1681
H10	2.1577	2.6152	3.6908	2.3949	3.4851	1.0835	4.3025	3.8033	3.8033		1.7608	1.7608
H11	2.1471	3.1908	4.1099	3.4713	2.8141	1.0879	3.8033	3.1681	2.6414	1.7608		1.7492
H12	2.1471	3.1908	4.1099	3.4713	2.8141	1.0879	3.8033	2.6414	3.1681	1.7608	1.7492

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H3	121.654	C1	C2	H4	121.654
C1	C5	H7	111.729	C1	C5	H8	110.607
C1	C5	H9	110.607	C1	C6	H10	111.729
C1	C6	H11	110.607	C1	C6	H12	110.607
C2	C1	C5	122.236	C2	C1	C6	122.236
H3	C2	H4	116.691	C5	C1	C6	115.528
H7	C5	H8	108.364	H7	C5	H9	108.364
H8	C5	H9	107.011	H10	C6	H11	108.364
H10	C6	H12	108.364	H11	C6	H12	107.011

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

using model chemistry: HF/6-311G**

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	C	-0.213
2	C	-0.168
3	H	0.092
4	H	0.092
5	C	-0.188
6	C	-0.188
7	H	0.094
8	H	0.096
9	H	0.096
10	H	0.094
11	H	0.096
12	H	0.096

<r²>	90.531
(<r²>)^1/2	9.515

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

using model chemistry: HF/6-311G**

States and conformations

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