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	hartrees
Energy at 0K	-156.165735
Energy at 298.15K	-156.173905
Nuclear repulsion energy	120.359385

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3276	2976	10.18
2	A₁	3237	2941	25.84
3	A₁	3151	2863	53.50
4	A₁	1847	1678	32.67
5	A₁	1620	1472	14.68
6	A₁	1564	1422	0.70
7	A₁	1532	1392	0.46
8	A₁	1174	1066	1.97
9	A₁	856	778	0.03
10	A₁	404	367	0.44
11	A₂	3185	2894	0.00
12	A₂	1590	1444	0.00
13	A₂	1106	1004	0.00
14	A₂	765	695	0.00
15	A₂	182	165	0.00
16	B₁	3191	2899	60.55
17	B₁	1608	1461	15.12
18	B₁	1206	1096	0.22
19	B₁	1041	946	57.44
20	B₁	480	436	9.28
21	B₁	228	208	0.39
22	B₂	3350	3044	21.82
23	B₂	3235	2939	34.78
24	B₂	3144	2857	20.41
25	B₂	1601	1454	3.91
26	B₂	1539	1398	6.28
27	B₂	1398	1270	2.47
28	B₂	1060	963	0.25
29	B₂	1032	938	0.00
30	B₂	470	427	1.66

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.128
C2	0.000	0.000	1.446
H3	0.000	0.915	2.010
H4	0.000	-0.915	2.010
C5	0.000	1.273	-0.675
C6	0.000	-1.273	-0.675
H7	0.000	2.147	-0.040
H8	0.873	1.318	-1.320
H9	-0.873	1.318	-1.320
H10	0.000	-2.147	-0.040
H11	-0.873	-1.318	-1.320
H12	0.873	-1.318	-1.320

	C1	C2	H3	H4	C5	C6	H7	H8	H9	H10	H11	H12
C1		1.3186	2.0928	2.0928	1.5047	1.5047	2.1539	2.1433	2.1433	2.1539	2.1433	2.1433
C2	1.3186		1.0745	1.0745	2.4739	2.4739	2.6114	3.1858	3.1858	2.6114	3.1858	3.1858
H3	2.0928	1.0745		1.8294	2.7090	3.4633	2.3918	3.4658	3.4658	3.6848	4.1029	4.1029
H4	2.0928	1.0745	1.8294		3.4633	2.7090	3.6848	4.1029	4.1029	2.3918	3.4658	3.4658
C5	1.5047	2.4739	2.7090	3.4633		2.5450	1.0814	1.0859	1.0859	3.4785	2.8085	2.8085
C6	1.5047	2.4739	3.4633	2.7090	2.5450		3.4785	2.8085	2.8085	1.0814	1.0859	1.0859
H7	2.1539	2.6114	2.3918	3.6848	1.0814	3.4785		1.7574	1.7574	4.2949	3.7959	3.7959
H8	2.1433	3.1858	3.4658	4.1029	1.0859	2.8085	1.7574		1.7454	3.7959	3.1614	2.6359
H9	2.1433	3.1858	3.4658	4.1029	1.0859	2.8085	1.7574	1.7454		3.7959	2.6359	3.1614
H10	2.1539	2.6114	3.6848	2.3918	3.4785	1.0814	4.2949	3.7959	3.7959		1.7574	1.7574
H11	2.1433	3.1858	4.1029	3.4658	2.8085	1.0859	3.7959	3.1614	2.6359	1.7574		1.7454
H12	2.1433	3.1858	4.1029	3.4658	2.8085	1.0859	3.7959	2.6359	3.1614	1.7574	1.7454

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H3	121.646	C1	C2	H4	121.646
C1	C5	H7	111.752	C1	C5	H8	110.618
C1	C5	H9	110.618	C1	C6	H10	111.752
C1	C6	H11	110.618	C1	C6	H12	110.618
C2	C1	C5	122.252	C2	C1	C6	122.252
H3	C2	H4	116.709	C5	C1	C6	115.497
H7	C5	H8	108.361	H7	C5	H9	108.361
H8	C5	H9	106.968	H10	C6	H11	108.361
H10	C6	H12	108.361	H11	C6	H12	106.968

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

using model chemistry: HF/6-311+G(3df,2p)

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	0.308
2	C	-0.486
3	H	0.114
4	H	0.114
5	C	-0.401
6	C	-0.401
7	H	0.106
8	H	0.136
9	H	0.136
10	H	0.106
11	H	0.136
12	H	0.136

<r²>	0.000
(<r²>)^1/2	0.000

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

using model chemistry: HF/6-311+G(3df,2p)

States and conformations

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