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	hartrees
Energy at 0K	-194.530428
Energy at 298.15K	-194.540265
HF Energy	-194.064027
Nuclear repulsion energy	173.063944

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3183	3039	32.03
2	A	3167	3024	22.98
3	A	3149	3007	23.83
4	A	3143	3001	3.96
5	A	3077	2938	13.08
6	A	3073	2934	28.67
7	A	3065	2927	18.75
8	A	1730	1652	0.11
9	A	1603	1531	10.84
10	A	1596	1524	2.04
11	A	1590	1518	0.88
12	A	1502	1434	3.38
13	A	1490	1423	5.95
14	A	1476	1409	2.83
15	A	1438	1373	2.87
16	A	1251	1194	4.31
17	A	1160	1108	8.46
18	A	1101	1052	5.36
19	A	997	952	1.07
20	A	969	925	1.80
21	A	754	720	1.65
22	A	533	509	2.07
23	A	390	373	0.30
24	A	309	295	0.16
25	A	3128	2987	35.24
26	A	3127	2986	26.97
27	A	3124	2982	0.30
28	A	1596	1524	19.20
29	A	1590	1519	0.37
30	A	1578	1507	1.14
31	A	1168	1115	0.73
32	A	1125	1074	0.15
33	A	1078	1030	1.94
34	A	850	812	16.27
35	A	440	420	3.45
36	A	260	248	1.88
37	A	185	176	0.97
38	A	138	132	0.43
39	A	97	92	0.42

Atom	x (Å)	y (Å)	z (Å)
C1	-1.524	0.481	0.000
H2	-1.961	-0.521	0.000
H3	-1.888	1.017	0.886
H4	-1.888	1.017	-0.886
C5	0.286	-2.112	0.000
H6	0.665	-2.637	-0.886
H7	0.665	-2.637	0.886
H8	-0.804	-2.187	0.000
C9	0.756	-0.665	0.000
H10	1.840	-0.543	0.000
C11	0.000	0.450	0.000
C12	0.644	1.834	0.000
H13	1.737	1.757	0.000
H14	0.334	2.402	0.887
H15	0.334	2.402	-0.887

	C1	H2	H3	H4	C5	H6	H7	H8	C9	H10	C11	C12	H13	H14	H15
C1		1.0928	1.0976	1.0976	3.1623	3.9114	3.9114	2.7636	2.5520	3.5168	1.5248	2.5559	3.5017	2.8156	2.8156
H2	1.0928		1.7763	1.7763	2.7535	3.4869	3.4869	2.0286	2.7206	3.8013	2.1882	3.5117	4.3427	3.8201	3.8201
H3	1.0976	1.7763		1.7726	3.9114	4.7965	4.4572	3.4964	3.2561	4.1369	2.1611	2.8039	3.8037	2.6176	3.1616
H4	1.0976	1.7763	1.7726		3.9114	4.4572	4.7965	3.4964	3.2561	4.1369	2.1611	2.8039	3.8037	3.1616	2.6176
C5	3.1623	2.7535	3.9114	3.9114		1.0971	1.0971	1.0931	1.5205	2.2082	2.5775	3.9621	4.1311	4.5999	4.5999
H6	3.9114	3.4869	4.7965	4.4572	1.0971		1.7712	1.7733	2.1634	2.5598	3.2796	4.5583	4.6083	5.3517	5.0497
H7	3.9114	3.4869	4.4572	4.7965	1.0971	1.7712		1.7733	2.1634	2.5598	3.2796	4.5583	4.6083	5.0497	5.3517
H8	2.7636	2.0286	3.4964	3.4964	1.0931	1.7733	1.7733		2.1792	3.1140	2.7570	4.2742	4.6913	4.8102	4.8102
C9	2.5520	2.7206	3.2561	3.2561	1.5205	2.1634	2.1634	2.1792		1.0914	1.3472	2.5022	2.6130	3.2205	3.2205
H10	3.5168	3.8013	4.1369	4.1369	2.2082	2.5598	2.5598	3.1140	1.0914		2.0908	2.6611	2.3014	3.4242	3.4242
C11	1.5248	2.1882	2.1611	2.1611	2.5775	3.2796	3.2796	2.7570	1.3472	2.0908		1.5267	2.1732	2.1695	2.1695
C12	2.5559	3.5117	2.8039	2.8039	3.9621	4.5583	4.5583	4.2742	2.5022	2.6611	1.5267		1.0957	1.0975	1.0975
H13	3.5017	4.3427	3.8037	3.8037	4.1311	4.6083	4.6083	4.6913	2.6130	2.3014	2.1732	1.0957		1.7808	1.7808
H14	2.8156	3.8201	2.6176	3.1616	4.5999	5.3517	5.0497	4.8102	3.2205	3.4242	2.1695	1.0975	1.7808		1.7735
H15	2.8156	3.8201	3.1616	2.6176	4.5999	5.0497	5.3517	4.8102	3.2205	3.4242	2.1695	1.0975	1.7808	1.7735

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C11	C9	125.280	C1	C11	C12	113.775
H2	C1	H3	108.381	H2	C1	H4	108.381
H2	C1	C11	112.391	H3	C1	H4	107.704
H3	C1	C11	109.926	H4	C1	C11	109.926
C5	C9	H10	114.433	C5	C9	C11	127.906
H6	C5	H7	107.650	H6	C5	H8	108.124
H6	C5	C9	110.432	H7	C5	H8	108.124
H7	C5	C9	110.432	H8	C5	C9	111.939
C9	C11	C12	120.945	H10	C9	C11	117.661
C11	C12	H13	110.863	C11	C12	H14	110.462
C11	C12	H15	110.462	H13	C12	H14	108.583
H13	C12	H15	108.583	H14	C12	H15	107.801

All results from a given calculation for C₅H₁₀ (2-Butene, 2-methyl-)

using model chemistry: MP2=FULL/3-21G

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 C5H10 (2-Butene, 2-methyl-)

using model chemistry: MP2=FULL/3-21G

States and conformations

All results from a given calculation for C₅H₁₀ (2-Butene, 2-methyl-)