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	hartrees
Energy at 0K	-196.412912
Energy at 298.15K	-196.422589
HF Energy	-196.412912
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3092	3031	51.83
2	A'	3084	3023	47.16
3	A'	3069	3009	23.83
4	A'	3065	3005	4.37
5	A'	2972	2914	14.35
6	A'	2969	2911	95.22
7	A'	2961	2903	36.07
8	A'	1719	1685	0.89
9	A'	1501	1472	8.39
10	A'	1499	1470	1.33
11	A'	1484	1455	1.12
12	A'	1422	1394	0.48
13	A'	1412	1385	0.27
14	A'	1407	1379	3.82
15	A'	1366	1339	5.17
16	A'	1222	1198	5.51
17	A'	1122	1100	9.98
18	A'	1060	1040	6.40
19	A'	961	942	2.01
20	A'	954	935	1.64
21	A'	764	749	1.80
22	A'	519	509	2.16
23	A'	381	373	0.39
24	A'	296	290	0.24
25	A"	3015	2956	70.60
26	A"	3014	2955	11.16
27	A"	3009	2950	20.97
28	A"	1492	1463	15.14
29	A"	1484	1455	1.49
30	A"	1473	1444	0.68
31	A"	1094	1073	0.50
32	A"	1046	1025	0.33
33	A"	1009	989	1.86
34	A"	808	792	11.38
35	A"	438	430	2.02
36	A"	256	251	1.32
37	A"	178	175	1.23
38	A"	138	135	0.07
39	A"	111	109	0.70

Atom	x (Å)	y (Å)	z (Å)
C1	-1.510	0.497	0.000
H2	-1.976	-0.495	0.000
H3	-1.882	1.045	0.883
H4	-1.882	1.045	-0.883
C5	0.268	-2.103	0.000
H6	0.650	-2.643	-0.883
H7	0.650	-2.643	0.883
H8	-0.825	-2.198	0.000
C9	0.739	-0.675	0.000
H10	1.829	-0.556	0.000
C11	0.000	0.453	0.000
C12	0.662	1.812	0.000
H13	1.758	1.736	0.000
H14	0.360	2.401	0.883
H15	0.360	2.401	-0.883

	C1	H2	H3	H4	C5	H6	H7	H8	C9	H10	C11	C12	H13	H14	H15
C1		1.0964	1.1034	1.1034	3.1501	3.9122	3.9122	2.7807	2.5362	3.5009	1.5105	2.5392	3.4951	2.8108	2.8108
H2	1.0964		1.7777	1.7777	2.7606	3.5054	3.5054	2.0550	2.7211	3.8052	2.1916	3.5050	4.3500	3.8242	3.8242
H3	1.1034	1.7777		1.7655	3.9129	4.8091	4.4731	3.5229	3.2566	4.1364	2.1610	2.7998	3.8086	2.6198	3.1593
H4	1.1034	1.7777	1.7655		3.9129	4.4731	4.8091	3.5229	3.2566	4.1364	2.1610	2.7998	3.8086	3.1593	2.6198
C5	3.1501	2.7606	3.9129	3.9129		1.1032	1.1032	1.0973	1.5043	2.1977	2.5702	3.9355	4.1185	4.5913	4.5913
H6	3.9122	3.5054	4.8091	4.4731	1.1032		1.7664	1.7761	2.1590	2.5542	3.2842	4.5419	4.6025	5.3523	5.0524
H7	3.9122	3.5054	4.4731	4.8091	1.1032	1.7664		1.7761	2.1590	2.5542	3.2842	4.5419	4.6025	5.0524	5.3523
H8	2.7807	2.0550	3.5229	3.5229	1.0973	1.7761	1.7761		2.1835	3.1209	2.7763	4.2773	4.7065	4.8308	4.8308
C9	2.5362	2.7211	3.2566	3.2566	1.5043	2.1590	2.1590	2.1835		1.0960	1.3484	2.4884	2.6174	3.2227	3.2227
H10	3.5009	3.8052	4.1364	4.1364	2.1977	2.5542	2.5542	3.1209	1.0960		2.0887	2.6402	2.2933	3.4182	3.4182
C11	1.5105	2.1916	2.1610	2.1610	2.5702	3.2842	3.2842	2.7763	1.3484	2.0887		1.5122	2.1768	2.1692	2.1692
C12	2.5392	3.5050	2.7998	2.7998	3.9355	4.5419	4.5419	4.2773	2.4884	2.6402	1.5122		1.0987	1.1037	1.1037
H13	3.4951	4.3500	3.8086	3.8086	4.1185	4.6025	4.6025	4.7065	2.6174	2.2933	2.1768	1.0987		1.7828	1.7828
H14	2.8108	3.8242	2.6198	3.1593	4.5913	5.3523	5.0524	4.8308	3.2227	3.4182	2.1692	1.1037	1.7828		1.7662
H15	2.8108	3.8242	3.1593	2.6198	4.5913	5.0524	5.3523	4.8308	3.2227	3.4182	2.1692	1.1037	1.7828	1.7662

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C11	C9	124.937	C1	C11	C12	114.303
H2	C1	H3	107.812	H2	C1	H4	107.812
H2	C1	C11	113.516	H3	C1	H4	106.324
H3	C1	C11	110.535	H4	C1	C11	110.535
C5	C9	H10	114.471	C5	C9	C11	128.537
H6	C5	H7	106.425	H6	C5	H8	107.625
H6	C5	C9	110.844	H7	C5	H8	107.625
H7	C5	C9	110.844	H8	C5	C9	113.174
C9	C11	C12	120.760	H10	C9	C11	116.992
C11	C12	H13	112.012	C11	C12	H14	111.091
C11	C12	H15	111.091	H13	C12	H14	108.049
H13	C12	H15	108.049	H14	C12	H15	106.312

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

using model chemistry: B97D3/6-31G*

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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Number	Element	Mulliken
1	C	-0.524
2	H	0.157
3	H	0.155
4	H	0.155
5	C	-0.500
6	H	0.157
7	H	0.157
8	H	0.156
9	C	-0.158
10	H	0.115
11	C	0.188
12	C	-0.517
13	H	0.154
14	H	0.152
15	H	0.152

	x	y	z	Total
	-0.177	0.046	0.000	0.183
CHELPG
AIM
ESP

	x	y	z
x	8.374	-1.060	0.000
y	-1.060	10.715	0.000
z	0.000	0.000	5.802

<r²>	152.003
(<r²>)^1/2	12.329

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

using model chemistry: B97D3/6-31G*

States and conformations

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