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	hartrees
Energy at 0K	-195.342623
Energy at 298.15K	-195.352395
Nuclear repulsion energy	172.457187

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3066	3049	50.09
2	A	3056	3039	24.66
3	A	3041	3024	8.02
4	A	3035	3019	13.05
5	A	2956	2940	16.90
6	A	2953	2937	61.77
7	A	2947	2931	20.89
8	A	1683	1674	0.46
9	A	1531	1522	10.83
10	A	1523	1515	1.59
11	A	1514	1506	1.40
12	A	1432	1424	2.64
13	A	1423	1415	2.80
14	A	1410	1402	3.34
15	A	1381	1373	4.58
16	A	1200	1193	6.25
17	A	1112	1106	12.37
18	A	1057	1051	6.57
19	A	954	948	0.46
20	A	936	930	3.63
21	A	737	733	1.91
22	A	517	515	2.23
23	A	372	370	0.49
24	A	298	296	0.19
25	A	2989	2972	55.39
26	A	2984	2968	16.15
27	A	2983	2967	10.58
28	A	1526	1518	18.65
29	A	1522	1513	1.88
30	A	1507	1499	1.00
31	A	1108	1102	2.54
32	A	1066	1061	0.00
33	A	1025	1019	1.80
34	A	815	811	15.45
35	A	426	424	3.15
36	A	253	252	1.90
37	A	187	186	1.35
38	A	166	165	0.06
39	A	123	122	0.95

Atom	x (Å)	y (Å)	z (Å)
C1	-1.528	0.479	0.000
H2	-1.969	-0.528	0.000
H3	-1.899	1.021	0.890
H4	-1.899	1.021	-0.890
C5	0.287	-2.114	0.000
H6	0.673	-2.648	-0.889
H7	0.673	-2.648	0.889
H8	-0.809	-2.200	0.000
C9	0.756	-0.667	0.000
H10	1.847	-0.544	0.000
C11	0.000	0.451	0.000
C12	0.647	1.838	0.000
H13	1.746	1.768	0.000
H14	0.332	2.415	0.890
H15	0.332	2.415	-0.890

	C1	H2	H3	H4	C5	H6	H7	H8	C9	H10	C11	C12	H13	H14	H15
C1		1.0992	1.1062	1.1062	3.1652	3.9254	3.9254	2.7734	2.5556	3.5262	1.5280	2.5644	3.5186	2.8284	2.8284
H2	1.0992		1.7876	1.7876	2.7581	3.5019	3.5019	2.0348	2.7289	3.8159	2.1990	3.5271	4.3673	3.8403	3.8403
H3	1.1062	1.7876		1.7797	3.9245	4.8206	4.4804	3.5147	3.2702	4.1560	2.1732	2.8179	3.8259	2.6308	3.1765
H4	1.1062	1.7876	1.7797		3.9245	4.4804	4.8206	3.5147	3.2702	4.1560	2.1732	2.8179	3.8259	3.1765	2.6308
C5	3.1652	2.7581	3.9245	3.9245		1.1062	1.1062	1.0999	1.5209	2.2133	2.5816	3.9690	4.1474	4.6161	4.6161
H6	3.9254	3.5019	4.8206	4.4804	1.1062		1.7781	1.7855	2.1723	2.5681	3.2935	4.5734	4.6305	5.3770	5.0741
H7	3.9254	3.5019	4.4804	4.8206	1.1062	1.7781		1.7855	2.1723	2.5681	3.2935	4.5734	4.6305	5.0741	5.3770
H8	2.7734	2.0348	3.5147	3.5147	1.0999	1.7855	1.7855		2.1908	3.1301	2.7719	4.2926	4.7196	4.8365	4.8365
C9	2.5556	2.7289	3.2702	3.2702	1.5209	2.1723	2.1723	2.1908		1.0975	1.3505	2.5083	2.6290	3.2363	3.2363
H10	3.5262	3.8159	4.1560	4.1560	2.2133	2.5681	2.5681	3.1301	1.0975		2.0979	2.6675	2.3142	3.4412	3.4412
C11	1.5280	2.1990	2.1732	2.1732	2.5816	3.2935	3.2935	2.7719	1.3505	2.0979		1.5304	2.1870	2.1814	2.1814
C12	2.5644	3.5271	2.8179	2.8179	3.9690	4.5734	4.5734	4.2926	2.5083	2.6675	1.5304		1.1017	1.1063	1.1063
H13	3.5186	4.3673	3.8259	3.8259	4.1474	4.6305	4.6305	4.7196	2.6290	2.3142	2.1870	1.1017		1.7917	1.7917
H14	2.8284	3.8403	2.6308	3.1765	4.6161	5.3770	5.0741	4.8365	3.2363	3.4412	2.1814	1.1063	1.7917		1.7804
H15	2.8284	3.8403	3.1765	2.6308	4.6161	5.0741	5.3770	4.8365	3.2363	3.4412	2.1814	1.1063	1.7917	1.7804

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C11	C9	125.094	C1	C11	C12	113.959
H2	C1	H3	108.307	H2	C1	H4	108.307
H2	C1	C11	112.634	H3	C1	H4	107.115
H3	C1	C11	110.149	H4	C1	C11	110.149
C5	C9	H10	114.432	C5	C9	C11	127.975
H6	C5	H7	106.975	H6	C5	H8	108.059
H6	C5	C9	110.561	H7	C5	H8	108.059
H7	C5	C9	110.561	H8	C5	C9	112.426
C9	C11	C12	120.947	H10	C9	C11	117.593
C11	C12	H13	111.337	C11	C12	H14	110.627
C11	C12	H15	110.627	H13	C12	H14	108.477
H13	C12	H15	108.477	H14	C12	H15	107.162

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

using model chemistry: BLYP/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	-0.572
2	H	0.186
3	H	0.184
4	H	0.184
5	C	-0.576
6	H	0.186
7	H	0.186
8	H	0.185
9	C	-0.148
10	H	0.150
11	C	0.048
12	C	-0.554
13	H	0.179
14	H	0.181
15	H	0.181

	x	y	z	Total
	-0.190	0.053	0.000	0.197
CHELPG
AIM
ESP

<r²>	153.675
(<r²>)^1/2	12.397

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

using model chemistry: BLYP/3-21G

States and conformations

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