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	hartrees
Energy at 0K	-195.873387
Energy at 298.15K	-195.883578
HF Energy	-195.159166
Nuclear repulsion energy	176.118409

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3329	3118	17.06
2	A	3231	3026	21.03
3	A	3230	3025	17.18
4	A	3224	3019	4.97
5	A	3223	3018	43.37
6	A	3195	2992	21.71
7	A	3172	2971	15.66
8	A	3130	2931	22.70
9	A	3116	2918	18.67
10	A	3109	2912	26.74
11	A	1746	1635	5.14
12	A	1567	1468	1.21
13	A	1562	1463	4.96
14	A	1554	1456	7.60
15	A	1544	1445	8.38
16	A	1532	1435	1.78
17	A	1497	1401	0.60
18	A	1461	1368	2.35
19	A	1458	1365	2.93
20	A	1399	1310	1.64
21	A	1347	1261	1.48
22	A	1314	1231	1.59
23	A	1148	1075	0.63
24	A	1129	1057	4.89
25	A	1085	1016	0.27
26	A	1059	992	0.87
27	A	1026	961	0.67
28	A	975	913	0.91
29	A	908	850	38.55
30	A	818	766	1.29
31	A	799	748	1.00
32	A	739	692	0.12
33	A	536	502	4.65
34	A	434	406	1.64
35	A	401	376	0.50
36	A	272	255	0.07
37	A	229	214	0.37
38	A	182	170	0.28
39	A	65	61	0.03

Atom	x (Å)	y (Å)	z (Å)
C1	0.959	1.340	0.031
H2	0.361	1.872	-0.710
H3	2.008	1.462	-0.232
H4	0.787	1.829	0.992
C5	-1.896	0.079	-0.394
H6	-1.880	1.165	-0.471
H7	-2.888	-0.214	-0.051
H8	-1.746	-0.333	-1.392
C9	-0.817	-0.434	0.562
H10	-0.919	-1.515	0.677
H11	-0.979	0.006	1.551
C12	0.582	-0.115	0.102
C13	1.445	-1.084	-0.236
H14	1.169	-2.128	-0.182
H15	2.449	-0.857	-0.570

	C1	H2	H3	H4	C5	H6	H7	H8	C9	H10	H11	C12	C13	H14	H15
C1		1.0909	1.0887	1.0919	3.1504	2.8882	4.1499	3.4845	2.5653	3.4770	2.8004	1.5041	2.4861	3.4806	2.7215
H2	1.0909		1.7632	1.7550	2.9003	2.3620	3.9170	3.1252	2.8845	3.8766	3.2230	2.1572	3.1836	4.1145	3.4384
H3	1.0887	1.7632		1.7678	4.1459	3.9067	5.1786	4.3203	3.4939	4.2726	3.7711	2.1524	2.6076	3.6877	2.3850
H4	1.0919	1.7550	1.7678		3.4906	3.1131	4.3319	4.0954	2.8066	3.7666	2.5984	2.1478	3.2289	4.1452	3.5241
C5	3.1504	2.9003	4.1459	3.4906		1.0889	1.0895	1.0895	1.5302	2.1544	2.1520	2.5350	3.5418	3.7828	4.4483
H6	2.8882	2.3620	3.9067	3.1131	1.0889		1.7590	1.7631	2.1797	3.0692	2.4985	2.8329	4.0209	4.4965	4.7784
H7	4.1499	3.9170	5.1786	4.3319	1.0895	1.7590		1.7652	2.1711	2.4699	2.5020	3.4749	4.4239	4.4877	5.4006
H8	3.4845	3.1252	4.3203	4.0954	1.0895	1.7631	1.7652		2.1655	2.5219	3.0599	2.7747	3.4767	3.6309	4.3067
C9	2.5653	2.8845	3.4939	2.8066	1.5302	2.1797	2.1711	2.1655		1.0916	1.0945	1.5068	2.4852	2.7140	3.4821
H10	3.4770	3.8766	4.2726	3.7666	2.1544	3.0692	2.4699	2.5219	1.0916		1.7548	2.1313	2.5704	2.3389	3.6507
H11	2.8004	3.2230	3.7711	2.5984	2.1520	2.4985	2.5020	3.0599	1.0945	1.7548		2.1331	3.2023	3.4881	4.1220
C12	1.5041	2.1572	2.1524	2.1478	2.5350	2.8329	3.4749	2.7747	1.5068	2.1313	2.1331		1.3410	2.1161	2.1183
C13	2.4861	3.1836	2.6076	3.2289	3.5418	4.0209	4.4239	3.4767	2.4852	2.5704	3.2023	1.3410		1.0817	1.0818
H14	3.4806	4.1145	3.6877	4.1452	3.7828	4.4965	4.4877	3.6309	2.7140	2.3389	3.4881	2.1161	1.0817		1.8454
H15	2.7215	3.4384	2.3850	3.5241	4.4483	4.7784	5.4006	4.3067	3.4821	3.6507	4.1220	2.1183	1.0818	1.8454

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C12	C9	116.857	C1	C12	C13	121.705
H2	C1	H3	107.990	H2	C1	H4	107.029
H2	C1	C12	111.468	H3	C1	H4	108.327
H3	C1	C12	111.217	H4	C1	C12	110.647
C5	C9	H10	109.374	C5	C9	H11	109.012
C5	C9	C12	113.165	H6	C5	H7	107.700
H6	C5	H8	108.065	H6	C5	C9	111.546
H7	C5	H8	108.214	H7	C5	C9	110.816
H8	C5	C9	110.375	C9	C12	C13	121.437
H10	C9	H11	106.778	H10	C9	C12	109.169
H11	C9	C12	109.143	C12	C13	H14	121.359
C12	C13	H15	121.572	H14	C13	H15	117.069

All results from a given calculation for C₅H₁₀ (1-Butene, 2-methyl-)

using model chemistry: MP2/6-31G**

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 (1-Butene, 2-methyl-)

using model chemistry: MP2/6-31G**

States and conformations

All results from a given calculation for C₅H₁₀ (1-Butene, 2-methyl-)