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	hartrees
Energy at 0K	-33.154187
Energy at 298.15K	-33.164567
Nuclear repulsion energy	98.329296

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3405	3069	49.94
2	A	3328	3000	23.54
3	A	3300	2975	74.00
4	A	3293	2969	96.10
5	A	3282	2958	120.91
6	A	3267	2945	57.13
7	A	3260	2938	18.17
8	A	3212	2895	56.34
9	A	3201	2885	66.89
10	A	3200	2885	53.35
11	A	1847	1665	28.39
12	A	1645	1483	5.87
13	A	1637	1476	8.25
14	A	1635	1474	13.19
15	A	1628	1467	11.08
16	A	1618	1459	7.91
17	A	1583	1427	1.34
18	A	1560	1406	4.31
19	A	1555	1402	3.62
20	A	1488	1341	1.94
21	A	1432	1291	2.83
22	A	1383	1246	1.18
23	A	1219	1099	0.47
24	A	1201	1083	5.26
25	A	1154	1040	3.23
26	A	1106	997	1.92
27	A	1094	986	0.70
28	A	1067	962	89.78
29	A	1013	913	0.31
30	A	866	781	2.15
31	A	822	741	1.02
32	A	777	701	0.13
33	A	573	516	11.27
34	A	453	408	1.54
35	A	413	373	1.09
36	A	272	246	0.76
37	A	230	208	0.52
38	A	181	163	0.29
39	A	62	56	0.03

Atom	x (Å)	y (Å)	z (Å)
C1	1.058	1.312	0.023
H2	0.466	1.872	-0.702
H3	2.103	1.384	-0.271
H4	0.940	1.807	0.989
C5	-1.908	0.093	-0.406
H6	-1.855	1.169	-0.570
H7	-2.904	-0.135	-0.025
H8	-1.791	-0.402	-1.371
C9	-0.824	-0.391	0.593
H10	-0.961	-1.455	0.779
H11	-0.970	0.121	1.547
C12	0.603	-0.142	0.107
C13	1.428	-1.165	-0.227
H14	1.106	-2.195	-0.159
H15	2.437	-0.992	-0.573

	C1	H2	H3	H4	C5	H6	H7	H8	C9	H10	H11	C12	C13	H14	H15
C1		1.0910	1.0878	1.0921	3.2353	2.9763	4.2186	3.6056	2.6016	3.5079	2.8028	1.5261	2.5167	3.5120	2.7500
H2	1.0910		1.7623	1.7581	2.9807	2.4280	3.9801	3.2726	2.9087	3.9109	3.1916	2.1749	3.2205	4.1525	3.4786
H3	1.0878	1.7623		1.7662	4.2156	3.9750	5.2383	4.4231	3.5306	4.3069	3.7874	2.1727	2.6369	3.7165	2.4176
H4	1.0921	1.7581	1.7662		3.6052	3.2637	4.4251	4.2323	2.8464	3.7817	2.6085	2.1663	3.2480	4.1668	3.5374
C5	3.2353	2.9807	4.2156	3.6052		1.0901	1.0909	1.0906	1.5512	2.1668	2.1670	2.5738	3.5689	3.7920	4.4807
H6	2.9763	2.4280	3.9750	3.2637	1.0901		1.7606	1.7646	2.2021	3.0829	2.5231	2.8674	4.0422	4.5006	4.8048
H7	4.2186	3.9801	5.2383	4.4251	1.0909	1.7606		1.7667	2.1849	2.4825	2.5059	3.5101	4.4569	4.5105	5.4367
H8	3.6056	3.2726	4.4231	4.2323	1.0906	1.7646	1.7667		2.1892	2.5337	3.0764	2.8259	3.5001	3.6166	4.3427
C9	2.6016	2.9087	3.5306	2.8464	1.5512	2.2021	2.1849	2.1892		1.0887	1.0925	1.5286	2.5183	2.7471	3.5148
H10	3.5079	3.9109	4.3069	3.7817	2.1668	3.0829	2.4825	2.5337	1.0887		1.7530	2.1501	2.6082	2.3879	3.6862
H11	2.8028	3.1916	3.7874	2.6085	2.1670	2.5231	2.5059	3.0764	1.0925	1.7530		2.1493	3.2479	3.5474	4.1638
C12	1.5261	2.1749	2.1727	2.1663	2.5738	2.8674	3.5101	2.8259	1.5286	2.1501	2.1493		1.3550	2.1299	2.1316
C13	2.5167	3.2205	2.6369	3.2480	3.5689	4.0422	4.4569	3.5001	2.5183	2.6082	3.2479	1.3550		1.0812	1.0807
H14	3.5120	4.1525	3.7165	4.1668	3.7920	4.5006	4.5105	3.6166	2.7471	2.3879	3.5474	2.1299	1.0812		1.8410
H15	2.7500	3.4786	2.4176	3.5374	4.4807	4.8048	5.4367	4.3427	3.5148	3.6862	4.1638	2.1316	1.0807	1.8410

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C12	C9	116.789	C1	C12	C13	121.626
H2	C1	H3	107.959	H2	C1	H4	107.275
H2	C1	C12	111.316	H3	C1	H4	108.232
H3	C1	C12	111.334	H4	C1	C12	110.568
C5	C9	H10	109.074	C5	C9	H11	108.869
C5	C9	C12	113.378	H6	C5	H7	107.649
H6	C5	H8	108.036	H6	C5	C9	111.778
H7	C5	H8	108.162	H7	C5	C9	110.359
H8	C5	C9	110.722	C9	C12	C13	121.584
H10	C9	H11	106.965	H10	C9	C12	109.317
H11	C9	C12	109.039	C12	C13	H14	121.514
C12	C13	H15	121.727	H14	C13	H15	116.760

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

using model chemistry: HF/CEP-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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Number	Element	Mulliken
1	C	-0.387
2	H	0.108
3	H	0.138
4	H	0.105
5	C	-0.374
6	H	0.103
7	H	0.122
8	H	0.111
9	C	-0.111
10	H	0.116
11	H	0.076
12	C	0.230
13	C	-0.587
14	H	0.171
15	H	0.178

	x	y	z	Total
	-0.461	0.467	0.119	0.666
CHELPG
AIM
ESP

	x	y	z
x	8.450	-1.338	-0.620
y	-1.338	8.484	0.463
z	-0.620	0.463	5.782

<r²>	122.693
(<r²>)^1/2	11.077

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

using model chemistry: HF/CEP-31G

States and conformations

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