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	hartrees
Energy at 0K	-196.291082
Energy at 298.15K	-196.300757
Nuclear repulsion energy	173.649262

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3061	3029	55.62
2	A	3054	3022	38.88
3	A	3043	3011	18.98
4	A	3036	3005	3.77
5	A	2953	2922	10.54
6	A	2950	2919	85.50
7	A	2943	2912	31.16
8	A	1698	1681	1.11
9	A	1468	1453	14.79
10	A	1465	1450	2.58
11	A	1450	1435	2.37
12	A	1385	1371	1.80
13	A	1378	1364	3.27
14	A	1374	1359	10.59
15	A	1335	1321	2.03
16	A	1208	1195	4.76
17	A	1108	1097	10.45
18	A	1043	1032	7.76
19	A	947	937	3.44
20	A	936	926	0.84
21	A	762	754	1.90
22	A	514	508	2.19
23	A	373	369	0.42
24	A	291	288	0.25
25	A	2993	2962	26.73
26	A	2992	2961	41.75
27	A	2988	2957	19.08
28	A	1460	1445	24.21
29	A	1453	1437	3.04
30	A	1438	1423	0.92
31	A	1068	1057	0.28
32	A	1025	1014	0.40
33	A	987	977	2.60
34	A	795	787	14.35
35	A	437	433	3.49
36	A	256	254	2.00
37	A	180	178	1.42
38	A	143	142	0.03
39	A	119	118	0.76

Atom	x (Å)	y (Å)	z (Å)
C1	-1.507	0.496	0.000
H2	-1.975	-0.497	0.000
H3	-1.883	1.043	0.883
H4	-1.883	1.043	-0.883
C5	0.267	-2.099	0.000
H6	0.649	-2.642	-0.882
H7	0.649	-2.642	0.882
H8	-0.827	-2.199	0.000
C9	0.738	-0.674	0.000
H10	1.830	-0.553	0.000
C11	0.000	0.453	0.000
C12	0.661	1.809	0.000
H13	1.759	1.734	0.000
H14	0.362	2.402	0.883
H15	0.362	2.402	-0.883

	C1	H2	H3	H4	C5	H6	H7	H8	C9	H10	C11	C12	H13	H14	H15
C1		1.0982	1.1047	1.1047	3.1434	3.9082	3.9082	2.7788	2.5311	3.4978	1.5073	2.5351	3.4924	2.8117	2.8117
H2	1.0982		1.7777	1.7777	2.7560	3.5025	3.5025	2.0525	2.7188	3.8058	2.1923	3.5034	4.3500	3.8275	3.8275
H3	1.1047	1.7777		1.7653	3.9087	4.8073	4.4716	3.5218	3.2555	4.1372	2.1619	2.8005	3.8108	2.6246	3.1634
H4	1.1047	1.7777	1.7653		3.9087	4.4716	4.8073	3.5218	3.2555	4.1372	2.1619	2.8005	3.8108	3.1634	2.6246
C5	3.1434	2.7560	3.9087	3.9087		1.1043	1.1043	1.0991	1.5005	2.1982	2.5665	3.9283	4.1128	4.5879	4.5879
H6	3.9082	3.5025	4.8073	4.4716	1.1043		1.7650	1.7762	2.1586	2.5569	3.2838	4.5383	4.5999	5.3521	5.0524
H7	3.9082	3.5025	4.4716	4.8073	1.1043	1.7650		1.7762	2.1586	2.5569	3.2838	4.5383	4.5999	5.0524	5.3521
H8	2.7788	2.0525	3.5218	3.5218	1.0991	1.7762	1.7762		2.1847	3.1254	2.7780	4.2756	4.7065	4.8332	4.8332
C9	2.5311	2.7188	3.2555	3.2555	1.5005	2.1586	2.1586	2.1847		1.0990	1.3475	2.4848	2.6155	3.2225	3.2225
H10	3.4978	3.8058	4.1372	4.1372	2.1982	2.5569	2.5569	3.1254	1.0990		2.0886	2.6358	2.2880	3.4159	3.4159
C11	1.5073	2.1923	2.1619	2.1619	2.5665	3.2838	3.2838	2.7780	1.3475	2.0886		1.5087	2.1755	2.1699	2.1699
C12	2.5351	3.5034	2.8005	2.8005	3.9283	4.5383	4.5383	4.2756	2.4848	2.6358	1.5087		1.1001	1.1050	1.1050
H13	3.4924	4.3500	3.8108	3.8108	4.1128	4.5999	4.5999	4.7065	2.6155	2.2880	2.1755	1.1001		1.7828	1.7828
H14	2.8117	3.8275	2.6246	3.1634	4.5879	5.3521	5.0524	4.8332	3.2225	3.4159	2.1699	1.1050	1.7828		1.7666
H15	2.8117	3.8275	3.1634	2.6246	4.5879	5.0524	5.3521	4.8332	3.2225	3.4159	2.1699	1.1050	1.7828	1.7666

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C11	C9	124.806	C1	C11	C12	114.390
H2	C1	H3	107.606	H2	C1	H4	107.606
H2	C1	C11	113.648	H3	C1	H4	106.067
H3	C1	C11	110.779	H4	C1	C11	110.779
C5	C9	H10	114.591	C5	C9	C11	128.539
H6	C5	H7	106.094	H6	C5	H8	107.441
H6	C5	C9	111.020	H7	C5	H8	107.441
H7	C5	C9	111.020	H8	C5	C9	113.463
C9	C11	C12	120.804	H10	C9	C11	116.871
C11	C12	H13	112.055	C11	C12	H14	111.296
C11	C12	H15	111.296	H13	C12	H14	107.894
H13	C12	H15	107.894	H14	C12	H15	106.138

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

using model chemistry: PBEPBE/6-311G*

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	-0.697
2	H	0.219
3	H	0.221
4	H	0.221
5	C	-0.678
6	H	0.223
7	H	0.223
8	H	0.217
9	C	-0.202
10	H	0.175
11	C	0.110
12	C	-0.684
13	H	0.217
14	H	0.218
15	H	0.218

	x	y	z	Total
	-0.174	0.035	0.000	0.177
CHELPG
AIM
ESP

	x	y	z
x	9.068	-1.058	0.000
y	-1.058	11.538	0.000
z	0.000	0.000	6.420

<r²>	152.250
(<r²>)^1/2	12.339

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

using model chemistry: PBEPBE/6-311G*

States and conformations

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