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	hartrees
Energy at 0K	-196.434816
Energy at 298.15K	-196.444530
Nuclear repulsion energy	174.612059

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3166	3029	49.12
2	A	3159	3022	22.06
3	A	3145	3008	14.59
4	A	3142	3005	11.27
5	A	3046	2914	18.28
6	A	3043	2911	71.91
7	A	3037	2905	31.73
8	A	1764	1687	1.89
9	A	1494	1429	13.61
10	A	1490	1426	3.31
11	A	1476	1412	2.90
12	A	1415	1353	5.28
13	A	1413	1352	2.09
14	A	1406	1345	8.63
15	A	1359	1300	2.22
16	A	1240	1186	4.43
17	A	1133	1084	10.15
18	A	1065	1018	6.53
19	A	963	921	3.87
20	A	952	911	0.53
21	A	781	747	1.90
22	A	518	496	2.25
23	A	367	351	0.39
24	A	278	266	0.19
25	A	3099	2965	17.02
26	A	3097	2962	27.14
27	A	3095	2960	19.69
28	A	1487	1423	24.09
29	A	1480	1416	1.45
30	A	1468	1404	0.90
31	A	1094	1046	0.01
32	A	1054	1008	1.77
33	A	1008	964	3.24
34	A	825	789	14.59
35	A	447	428	3.70
36	A	262	251	2.22
37	A	182	174	1.60
38	A	134	129	0.06
39	A	117	112	1.06

Atom	x (Å)	y (Å)	z (Å)
C1	-1.501	0.494	0.000
H2	-1.962	-0.494	0.000
H3	-1.869	1.037	0.878
H4	-1.869	1.037	-0.878
C5	0.264	-2.090	0.000
H6	0.643	-2.625	-0.878
H7	0.643	-2.625	0.878
H8	-0.823	-2.181	0.000
C9	0.735	-0.670	0.000
H10	1.818	-0.548	0.000
C11	0.000	0.451	0.000
C12	0.660	1.801	0.000
H13	1.749	1.720	0.000
H14	0.361	2.385	0.878
H15	0.361	2.385	-0.878

	C1	H2	H3	H4	C5	H6	H7	H8	C9	H10	C11	C12	H13	H14	H15
C1		1.0896	1.0960	1.0960	3.1289	3.8846	3.8846	2.7597	2.5203	3.4780	1.5012	2.5251	3.4729	2.7954	2.7954
H2	1.0896		1.7666	1.7666	2.7392	3.4780	3.4780	2.0363	2.7023	3.7799	2.1772	3.4838	4.3205	3.8016	3.8016
H3	1.0960	1.7666		1.7560	3.8854	4.7747	4.4401	3.4958	3.2346	4.1076	2.1462	2.7835	3.7846	2.6058	3.1425
H4	1.0960	1.7666	1.7560		3.8854	4.4401	4.7747	3.4958	3.2346	4.1076	2.1462	2.7835	3.7846	3.1425	2.6058
C5	3.1289	2.7392	3.8854	3.8854		1.0955	1.0955	1.0906	1.4957	2.1889	2.5546	3.9112	4.0890	4.5614	4.5614
H6	3.8846	3.4780	4.7747	4.4401	1.0955		1.7558	1.7647	2.1448	2.5427	3.2627	4.5124	4.5688	5.3163	5.0178
H7	3.8846	3.4780	4.4401	4.7747	1.0955	1.7558		1.7647	2.1448	2.5427	3.2627	4.5124	4.5688	5.0178	5.3163
H8	2.7597	2.0363	3.4958	3.4958	1.0906	1.7647	1.7647		2.1700	3.1047	2.7578	4.2494	4.6725	4.7983	4.7983
C9	2.5203	2.7023	3.2346	3.2346	1.4957	2.1448	2.1448	2.1700		1.0899	1.3405	2.4726	2.5965	3.2009	3.2009
H10	3.4780	3.7799	4.1076	4.1076	2.1889	2.5427	2.5427	3.1047	1.0899		2.0742	2.6192	2.2692	3.3906	3.3906
C11	1.5012	2.1772	2.1462	2.1462	2.5546	3.2627	3.2627	2.7578	1.3405	2.0742		1.5027	2.1606	2.1546	2.1546
C12	2.5251	3.4838	2.7835	2.7835	3.9112	4.5124	4.5124	4.2494	2.4726	2.6192	1.5027		1.0920	1.0962	1.0962
H13	3.4729	4.3205	3.7846	3.7846	4.0890	4.5688	4.5688	4.6725	2.5965	2.2692	2.1606	1.0920		1.7718	1.7718
H14	2.7954	3.8016	2.6058	3.1425	4.5614	5.3163	5.0178	4.7983	3.2009	3.3906	2.1546	1.0962	1.7718		1.7570
H15	2.7954	3.8016	3.1425	2.6058	4.5614	5.0178	5.3163	4.7983	3.2009	3.3906	2.1546	1.0962	1.7718	1.7570

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C11	C9	124.872	C1	C11	C12	114.406
H2	C1	H3	107.857	H2	C1	H4	107.857
H2	C1	C11	113.405	H3	C1	H4	106.471
H3	C1	C11	110.482	H4	C1	C11	110.482
C5	C9	H10	114.777	C5	C9	C11	128.423
H6	C5	H7	106.521	H6	C5	H8	107.654
H6	C5	C9	110.787	H7	C5	H8	107.654
H7	C5	C9	110.787	H8	C5	C9	113.145
C9	C11	C12	120.723	H10	C9	C11	116.801
C11	C12	H13	111.780	C11	C12	H14	111.033
C11	C12	H15	111.033	H13	C12	H14	108.130
H13	C12	H15	108.130	H14	C12	H15	106.524

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

using model chemistry: B1B95/6-31+G**

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	-0.673
2	H	0.148
3	H	0.164
4	H	0.164
5	C	-0.702
6	H	0.165
7	H	0.165
8	H	0.148
9	C	-0.037
10	H	0.128
11	C	0.449
12	C	-0.597
13	H	0.156
14	H	0.161
15	H	0.161

	x	y	z	Total
	-0.203	0.052	0.000	0.209
CHELPG
AIM
ESP

	x	y	z
x	9.058	-1.129	0.000
y	-1.129	11.367	0.000
z	0.000	0.000	6.909

<r²>	150.690
(<r²>)^1/2	12.276

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

using model chemistry: B1B95/6-31+G**

States and conformations

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