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	hartrees
Energy at 0K	-195.362697
Energy at 298.15K	-195.372494
HF Energy	-195.362697
Nuclear repulsion energy	174.050987

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3163	2996	29.31
2	A'	3146	2980	0.32
3	A'	3128	2963	13.54
4	A'	3126	2961	10.24
5	A'	3053	2892	20.09
6	A'	3036	2876	9.13
7	A'	3033	2873	22.93
8	A'	1798	1703	0.65
9	A'	1567	1484	15.99
10	A'	1564	1482	3.14
11	A'	1550	1468	2.54
12	A'	1476	1398	4.57
13	A'	1464	1387	9.42
14	A'	1450	1374	9.20
15	A'	1425	1350	1.57
16	A'	1255	1189	4.64
17	A'	1154	1093	9.94
18	A'	1097	1039	8.07
19	A'	994	942	2.17
20	A'	977	926	3.06
21	A'	777	736	2.34
22	A'	534	506	2.65
23	A'	388	367	0.42
24	A'	315	298	0.21
25	A"	3111	2947	17.40
26	A"	3085	2923	12.52
27	A"	3081	2918	10.97
28	A"	1557	1475	28.19
29	A"	1552	1470	2.27
30	A"	1538	1457	0.15
31	A"	1147	1087	3.05
32	A"	1110	1052	0.03
33	A"	1057	1001	2.85
34	A"	872	826	17.49
35	A"	449	425	4.57
36	A"	262	248	2.08
37	A"	208	197	1.81
38	A"	116	110	0.38
39	A"	77	73	0.39

Atom	x (Å)	y (Å)	z (Å)
C1	-1.515	0.456	0.000
H2	-1.946	-0.546	0.000
H3	-1.883	0.992	0.884
H4	-1.883	0.992	-0.884
C5	0.301	-2.091	0.000
H6	0.685	-2.615	-0.883
H7	0.685	-2.615	0.883
H8	-0.787	-2.179	0.000
C9	0.762	-0.652	0.000
H10	1.843	-0.519	0.000
C11	0.000	0.444	0.000
C12	0.617	1.831	0.000
H13	1.709	1.780	0.000
H14	0.293	2.393	0.885
H15	0.293	2.393	-0.885

	C1	H2	H3	H4	C5	H6	H7	H8	C9	H10	C11	C12	H13	H14	H15
C1		1.0909	1.0975	1.0975	3.1285	3.8802	3.8802	2.7335	2.5326	3.4969	1.5153	2.5368	3.4857	2.7935	2.7935
H2	1.0909		1.7754	1.7754	2.7276	3.4624	3.4624	2.0026	2.7105	3.7896	2.1838	3.4956	4.3329	3.7993	3.7993
H3	1.0975	1.7754		1.7688	3.8804	4.7679	4.4280	3.4693	3.2372	4.1165	2.1510	2.7808	3.7821	2.5875	3.1345
H4	1.0975	1.7754	1.7688		3.8804	4.4280	4.7679	3.4693	3.2372	4.1165	2.1510	2.7808	3.7821	3.1345	2.5875
C5	3.1285	2.7276	3.8804	3.8804		1.0967	1.0967	1.0915	1.5109	2.2018	2.5529	3.9343	4.1191	4.5705	4.5705
H6	3.8802	3.4624	4.7679	4.4280	1.0967		1.7668	1.7713	2.1543	2.5526	3.2572	4.5333	4.5988	5.3258	5.0237
H7	3.8802	3.4624	4.4280	4.7679	1.0967	1.7668		1.7713	2.1543	2.5526	3.2572	4.5333	4.5988	5.0237	5.3258
H8	2.7335	2.0026	3.4693	3.4693	1.0915	1.7713	1.7713		2.1745	3.1095	2.7380	4.2477	4.6797	4.7798	4.7798
C9	2.5326	2.7105	3.2372	3.2372	1.5109	2.1543	2.1543	2.1745		1.0892	1.3349	2.4869	2.6100	3.2055	3.2055
H10	3.4969	3.7896	4.1165	4.1165	2.2018	2.5526	2.5526	3.1095	1.0892		2.0794	2.6502	2.3029	3.4155	3.4155
C11	1.5153	2.1838	2.1510	2.1510	2.5529	3.2572	3.2572	2.7380	1.3349	2.0794		1.5176	2.1694	2.1603	2.1603
C12	2.5368	3.4956	2.7808	2.7808	3.9343	4.5333	4.5333	4.2477	2.4869	2.6502	1.5176		1.0934	1.0974	1.0974
H13	3.4857	4.3329	3.7821	3.7821	4.1191	4.5988	4.5988	4.6797	2.6100	2.3029	2.1694	1.0934		1.7789	1.7789
H14	2.7935	3.7993	2.5875	3.1345	4.5705	5.3258	5.0237	4.7798	3.2055	3.4155	2.1603	1.0974	1.7789		1.7695
H15	2.7935	3.7993	3.1345	2.5875	4.5705	5.0237	5.3258	4.7798	3.2055	3.4155	2.1603	1.0974	1.7789	1.7695

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C11	C9	125.263	C1	C11	C12	113.531
H2	C1	H3	108.443	H2	C1	H4	108.443
H2	C1	C11	112.828	H3	C1	H4	107.383
H3	C1	C11	109.792	H4	C1	C11	109.792
C5	C9	H10	114.772	C5	C9	C11	127.440
H6	C5	H7	107.324	H6	C5	H8	108.094
H6	C5	C9	110.402	H7	C5	H8	108.094
H7	C5	C9	110.402	H8	C5	C9	112.351
C9	C11	C12	121.207	H10	C9	C11	117.789
C11	C12	H13	111.338	C11	C12	H14	110.378
C11	C12	H15	110.378	H13	C12	H14	108.587
H13	C12	H15	108.587	H14	C12	H15	107.463

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

using model chemistry: M06-2X/3-21G*

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	-0.599
2	H	0.205
3	H	0.205
4	H	0.205
5	C	-0.621
6	H	0.208
7	H	0.208
8	H	0.203
9	C	-0.188
10	H	0.185
11	C	-0.035
12	C	-0.582
13	H	0.200
14	H	0.202
15	H	0.202

	x	y	z	Total
	-0.181	0.070	0.000	0.194
CHELPG
AIM
ESP

	x	y	z
x	7.592	-1.101	0.000
y	-1.101	9.517	0.000
z	0.000	0.000	5.173

<r²>	151.098
(<r²>)^1/2	12.292

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

using model chemistry: M06-2X/3-21G*

States and conformations

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