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	hartrees
Energy at 0K	-194.182505
Energy at 298.15K	-194.191907
Nuclear repulsion energy	172.163413

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3490	3115	1.65
2	A	3486	3111	1.09
3	A	3480	3106	1.26
4	A	3424	3056	8.27
5	A	3300	2945	1.77
6	A	3297	2942	3.59
7	A	3294	2939	2.40
8	A	1894	1690	0.39
9	A	1687	1505	5.22
10	A	1683	1502	2.38
11	A	1679	1498	0.58
12	A	1583	1413	0.53
13	A	1568	1399	2.70
14	A	1566	1397	0.51
15	A	1478	1319	8.94
16	A	1330	1187	6.92
17	A	1210	1080	7.64
18	A	1147	1024	9.25
19	A	1050	937	1.32
20	A	1031	920	0.72
21	A	815	727	1.71
22	A	544	485	2.08
23	A	382	341	0.36
24	A	301	268	0.11
25	A	3443	3072	2.81
26	A	3442	3071	0.53
27	A	3438	3068	1.25
28	A	1677	1497	11.38
29	A	1674	1494	0.02
30	A	1669	1490	0.58
31	A	1195	1066	3.90
32	A	1151	1027	0.11
33	A	1106	987	1.05
34	A	889	793	7.93
35	A	456	407	1.51
36	A	259	231	1.44
37	A	160	143	0.38
38	A	124	111	0.01
39	A	100	89	0.32

Atom	x (Å)	y (Å)	z (Å)
C1	-1.537	0.468	0.000
H2	-1.964	-0.544	0.000
H3	-1.912	1.004	0.889
H4	-1.912	1.004	-0.889
C5	0.291	-2.116	0.000
H6	0.678	-2.644	-0.889
H7	0.678	-2.644	0.889
H8	-0.805	-2.201	0.000
C9	0.760	-0.660	0.000
H10	1.853	-0.537	0.000
C11	0.000	0.451	0.000
C12	0.648	1.847	0.000
H13	1.746	1.775	0.000
H14	0.335	2.421	0.889
H15	0.335	2.421	-0.889

	C1	H2	H3	H4	C5	H6	H7	H8	C9	H10	C11	C12	H13	H14	H15
C1		1.0983	1.1034	1.1034	3.1655	3.9223	3.9223	2.7680	2.5590	3.5362	1.5372	2.5841	3.5333	2.8473	2.8473
H2	1.0983		1.7852	1.7852	2.7484	3.4899	3.4899	2.0222	2.7258	3.8167	2.2011	3.5411	4.3744	3.8552	3.8552
H3	1.1034	1.7852		1.7777	3.9213	4.8141	4.4740	3.5052	3.2708	4.1646	2.1802	2.8389	3.8428	2.6569	3.1969
H4	1.1034	1.7852	1.7777		3.9213	4.4740	4.8141	3.5052	3.2708	4.1646	2.1802	2.8389	3.8428	3.1969	2.6569
C5	3.1655	2.7484	3.9213	3.9213		1.1038	1.1038	1.0987	1.5300	2.2212	2.5833	3.9796	4.1543	4.6236	4.6236
H6	3.9223	3.4899	4.8141	4.4740	1.1038		1.7772	1.7846	2.1758	2.5708	3.2906	4.5787	4.6324	5.3790	5.0768
H7	3.9223	3.4899	4.4740	4.8141	1.1038	1.7772		1.7846	2.1758	2.5708	3.2906	4.5787	4.6324	5.0768	5.3790
H8	2.7680	2.0222	3.5052	3.5052	1.0987	1.7846	1.7846		2.1962	3.1356	2.7712	4.3013	4.7237	4.8427	4.8427
C9	2.5590	2.7258	3.2708	3.2708	1.5300	2.1758	2.1758	2.1962		1.1002	1.3456	2.5097	2.6268	3.2346	3.2346
H10	3.5362	3.8167	4.1646	4.1646	2.2212	2.5708	2.5708	3.1356	1.1002		2.1001	2.6718	2.3148	3.4421	3.4421
C11	1.5372	2.2011	2.1802	2.1802	2.5833	3.2906	3.2906	2.7712	1.3456	2.1001		1.5397	2.1911	2.1873	2.1873
C12	2.5841	3.5411	2.8389	2.8389	3.9796	4.5787	4.5787	4.3013	2.5097	2.6718	1.5397		1.0998	1.1036	1.1036
H13	3.5333	4.3744	3.8428	3.8428	4.1543	4.6324	4.6324	4.7237	2.6268	2.3148	2.1911	1.0998		1.7885	1.7885
H14	2.8473	3.8552	2.6569	3.1969	4.6236	5.3790	5.0768	4.8427	3.2346	3.4421	2.1873	1.1036	1.7885		1.7782
H15	2.8473	3.8552	3.1969	2.6569	4.6236	5.0768	5.3790	4.8427	3.2346	3.4421	2.1873	1.1036	1.7885	1.7782

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C11	C9	125.033	C1	C11	C12	114.243
H2	C1	H3	108.354	H2	C1	H4	108.354
H2	C1	C11	112.193	H3	C1	H4	107.334
H3	C1	C11	110.228	H4	C1	C11	110.228
C5	C9	H10	114.246	C5	C9	C11	127.768
H6	C5	H7	107.222	H6	C5	H8	108.233
H6	C5	C9	110.349	H7	C5	H8	108.233
H7	C5	C9	110.349	H8	C5	C9	112.286
C9	C11	C12	120.724	H10	C9	C11	117.986
C11	C12	H13	111.126	C11	C12	H14	110.602
C11	C12	H15	110.602	H13	C12	H14	108.524
H13	C12	H15	108.524	H14	C12	H15	107.347

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

using model chemistry: B3LYP/STO-3G

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	-0.225
2	H	0.077
3	H	0.077
4	H	0.077
5	C	-0.225
6	H	0.078
7	H	0.078
8	H	0.077
9	C	-0.086
10	H	0.065
11	C	0.003
12	C	-0.223
13	H	0.076
14	H	0.076
15	H	0.076

	x	y	z	Total
	-0.157	0.075	0.000	0.174
CHELPG
AIM
ESP

	x	y	z
x	4.538	-0.853	0.000
y	-0.853	5.992	0.000
z	0.000	0.000	2.744

<r²>	152.669
(<r²>)^1/2	12.356

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

using model chemistry: B3LYP/STO-3G

States and conformations

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