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	hartrees
Energy at 0K	-195.210828
Energy at 298.15K	-195.221310
Nuclear repulsion energy	176.494662

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3348	3042	22.67
2	A	3274	2975	11.50
3	A	3236	2941	29.77
4	A	3225	2931	64.72
5	A	3215	2921	57.44
6	A	3199	2907	24.46
7	A	3192	2900	13.12
8	A	3159	2870	35.81
9	A	3153	2864	32.21
10	A	3141	2854	27.15
11	A	1841	1673	32.05
12	A	1628	1479	4.19
13	A	1618	1470	5.35
14	A	1615	1467	11.55
15	A	1607	1460	7.85
16	A	1596	1450	3.50
17	A	1568	1425	0.36
18	A	1537	1396	2.89
19	A	1531	1391	2.45
20	A	1475	1340	3.93
21	A	1415	1286	1.50
22	A	1373	1247	1.47
23	A	1212	1101	0.83
24	A	1189	1080	3.64
25	A	1137	1033	0.81
26	A	1087	988	0.17
27	A	1082	983	0.74
28	A	1044	948	54.26
29	A	1001	910	0.97
30	A	856	778	1.20
31	A	819	745	0.68
32	A	780	709	0.17
33	A	583	530	8.52
34	A	467	424	1.93
35	A	424	385	0.95
36	A	280	254	0.43
37	A	240	218	0.47
38	A	196	178	0.14
39	A	70	64	0.05

Atom	x (Å)	y (Å)	z (Å)
C1	1.007	1.320	0.023
H2	0.408	1.871	-0.693
H3	2.045	1.414	-0.266
H4	0.875	1.802	0.987
C5	-1.910	0.094	-0.391
H6	-1.882	1.169	-0.516
H7	-2.892	-0.165	-0.011
H8	-1.799	-0.360	-1.370
C9	-0.822	-0.401	0.566
H10	-0.941	-1.466	0.718
H11	-0.965	0.072	1.535
C12	0.586	-0.125	0.093
C13	1.410	-1.103	-0.231
H14	1.112	-2.134	-0.173
H15	2.413	-0.910	-0.565

	C1	H2	H3	H4	C5	H6	H7	H8	C9	H10	H11	C12	C13	H14	H15
C1		1.0843	1.0814	1.0859	3.1912	2.9425	4.1718	3.5540	2.5688	3.4701	2.7802	1.5065	2.4692	3.4607	2.7005
H2	1.0843		1.7524	1.7454	2.9365	2.4016	3.9368	3.2097	2.8738	3.8668	3.1758	2.1528	3.1723	4.0994	3.4307
H3	1.0814	1.7524		1.7568	4.1714	3.9424	5.1891	4.3746	3.4932	4.2642	3.7550	2.1508	2.5963	3.6698	2.3718
H4	1.0859	1.7454	1.7568		3.5466	3.2035	4.3655	4.1687	2.8127	3.7493	2.5848	2.1443	3.1953	4.1104	3.4822
C5	3.1912	2.9365	4.1714	3.5466		1.0832	1.0839	1.0840	1.5314	2.1457	2.1458	2.5522	3.5330	3.7607	4.4416
H6	2.9425	2.4016	3.9424	3.2035	1.0832		1.7478	1.7534	2.1815	3.0587	2.5001	2.8527	4.0105	4.4713	4.7722
H7	4.1718	3.9368	5.1891	4.3655	1.0839	1.7478		1.7543	2.1616	2.4554	2.4818	3.4795	4.4083	4.4643	5.3853
H8	3.5540	3.2097	4.3746	4.1687	1.0840	1.7534	1.7543		2.1684	2.5139	3.0524	2.8073	3.4850	3.6126	4.3232
C9	2.5688	2.8738	3.4932	2.8127	1.5314	2.1815	2.1616	2.1684		1.0832	1.0874	1.5106	2.4719	2.6999	3.4644
H10	3.4701	3.8668	4.2642	3.7493	2.1457	3.0587	2.4554	2.5139	1.0832		1.7415	2.1268	2.5619	2.3359	3.6344
H11	2.7802	3.1758	3.7550	2.5848	2.1458	2.5001	2.4818	3.0524	1.0874	1.7415		2.1267	3.1840	3.4777	4.0964
C12	1.5065	2.1528	2.1508	2.1443	2.5522	2.8527	3.4795	2.8073	1.5106	2.1268	2.1267		1.3192	2.0934	2.0942
C13	2.4692	3.1723	2.5963	3.1953	3.5330	4.0105	4.4083	3.4850	2.4719	2.5619	3.1840	1.3192		1.0746	1.0746
H14	3.4607	4.0994	3.6698	4.1104	3.7607	4.4713	4.4643	3.6126	2.6999	2.3359	3.4777	2.0934	1.0746		1.8290
H15	2.7005	3.4307	2.3718	3.4822	4.4416	4.7722	5.3853	4.3232	3.4644	3.6344	4.0964	2.0942	1.0746	1.8290

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C12	C9	116.730	C1	C12	C13	121.674
H2	C1	H3	108.023	H2	C1	H4	107.073
H2	C1	C12	111.346	H3	C1	H4	108.308
H3	C1	C12	111.363	H4	C1	C12	110.565
C5	C9	H10	109.105	C5	C9	H11	108.863
C5	C9	C12	114.064	H6	C5	H7	107.513
H6	C5	H8	108.008	H6	C5	C9	111.958
H7	C5	H8	108.045	H7	C5	C9	110.312
H8	C5	C9	110.854	C9	C12	C13	121.593
H10	C9	H11	106.708	H10	C9	C12	109.052
H11	C9	C12	108.793	C12	C13	H14	121.633
C12	C13	H15	121.724	H14	C13	H15	116.643

All results from a given calculation for C₅H₁₀ (1-Butene, 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	-0.355
2	H	0.137
3	H	0.104
4	H	0.136
5	C	-0.436
6	H	0.133
7	H	0.120
8	H	0.134
9	C	-0.265
10	H	0.094
11	H	0.133
12	C	0.450
13	C	-0.620
14	H	0.114
15	H	0.120

	x	y	z	Total
	-0.396	0.397	0.137	0.577
CHELPG
AIM
ESP

	x	y	z
x	9.974	-0.958	-0.369
y	-0.958	9.514	0.308
z	-0.369	0.308	7.559

<r²>	0.000
(<r²>)^1/2	0.000

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

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

States and conformations

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