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	hartrees
Energy at 0K	-233.053676
Energy at 298.15K	-233.065192
Nuclear repulsion energy	235.790354

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3360	3038	42.00
2	A	3332	3013	17.51
3	A	3229	2920	129.46
4	A	3224	2916	55.64
5	A	3207	2901	31.37
6	A	3200	2894	58.45
7	A	3171	2868	13.38
8	A	3170	2867	65.94
9	A	3154	2853	59.95
10	A	3153	2852	22.68
11	A	1829	1654	3.08
12	A	1637	1481	3.90
13	A	1632	1476	1.91
14	A	1631	1475	3.36
15	A	1626	1470	1.21
16	A	1552	1403	3.15
17	A	1515	1370	2.20
18	A	1502	1358	0.73
19	A	1468	1328	3.93
20	A	1433	1296	0.19
21	A	1422	1286	4.17
22	A	1354	1225	0.44
23	A	1278	1156	0.96
24	A	1254	1134	1.48
25	A	1226	1109	0.33
26	A	1203	1088	5.17
27	A	1146	1037	2.69
28	A	1086	982	0.78
29	A	1063	961	5.16
30	A	1034	936	1.76
31	A	1012	915	5.90
32	A	991	896	2.23
33	A	976	883	3.16
34	A	878	794	1.36
35	A	834	754	0.71
36	A	775	701	44.78
37	A	612	553	3.04
38	A	457	413	0.75
39	A	429	388	0.01
40	A	334	302	0.03
41	A	269	243	0.01
42	A	122	110	0.06

Atom	x (Å)	y (Å)	z (Å)
H1	-2.432	-1.276	-0.125
C2	-1.552	-0.659	-0.060
H3	-2.432	1.276	-0.125
C4	-1.552	0.659	-0.060
H5	0.134	-1.611	-0.990
H6	-0.047	-2.044	0.689
C7	-0.152	-1.223	-0.013
H8	-0.046	2.045	0.688
H9	0.134	1.610	-0.991
C10	-0.152	1.223	-0.013
H11	0.769	0.000	1.474
C12	0.704	0.000	0.388
H13	2.673	-0.876	0.142
H14	2.673	0.876	0.142
H15	2.104	-0.000	-1.267
C16	2.117	-0.000	-0.181

	H1	C2	H3	C4	H5	H6	C7	H8	H9	C10	H11	C12	H13	H14	H15	C16
H1		1.0758	2.5519	2.1265	2.7279	2.6347	2.2824	4.1696	3.9568	3.3839	3.7986	3.4235	5.1271	5.5457	4.8474	4.7247
C2	1.0758		2.1265	1.3184	2.1482	2.1791	1.5099	3.1851	2.9759	2.3461	2.8596	2.3928	4.2357	4.4998	3.9060	3.7304
H3	2.5519	2.1265		1.0759	3.9582	4.1685	3.3839	2.6355	2.7282	2.2828	3.7984	3.4236	5.5460	5.1269	4.8479	4.7249
C4	2.1265	1.3184	1.0759		2.9772	3.1843	2.3461	2.1799	2.1477	1.5101	2.8596	2.3928	4.5001	4.2355	3.9062	3.7305
H5	2.7279	2.1482	3.9582	2.9772		1.7436	1.0896	4.0273	3.2209	3.0113	3.0117	2.1957	2.8757	3.7300	2.5596	2.6806
H6	2.6347	2.1791	4.1685	3.1843	1.7436		1.0862	4.0899	4.0258	3.3435	2.3370	2.1985	3.0102	4.0279	3.5536	3.1015
C7	2.2824	1.5099	3.3839	2.3461	1.0896	1.0862		3.3442	3.0099	2.4454	2.1344	1.5457	2.8508	3.5228	2.8559	2.5836
H8	4.1696	3.1851	2.6355	2.1799	4.0273	4.0899	3.3442		1.7436	1.0861	2.3375	2.1987	4.0276	3.0091	3.5533	3.1010
H9	3.9568	2.9759	2.7282	2.1477	3.2209	4.0258	3.0099	1.7436		1.0897	3.0111	2.1948	3.7292	2.8750	2.5589	2.6798
C10	3.3839	2.3461	2.2828	1.5101	3.0113	3.3435	2.4454	1.0861	1.0897		2.1339	1.5454	3.5226	2.8502	2.8560	2.5834
H11	3.7986	2.8596	3.7984	2.8596	3.0117	2.3370	2.1344	2.3375	3.0111	2.1339		1.0872	2.4829	2.4829	3.0482	2.1340
C12	3.4235	2.3928	3.4236	2.3928	2.1957	2.1985	1.5457	2.1987	2.1948	1.5454	1.0872		2.1693	2.1692	2.1680	1.5240
H13	5.1271	4.2357	5.5460	4.5001	2.8757	3.0102	2.8508	4.0276	3.7292	3.5226	2.4829	2.1693		1.7517	1.7537	1.0861
H14	5.5457	4.4998	5.1269	4.2355	3.7300	4.0279	3.5228	3.0091	2.8750	2.8502	2.4829	2.1692	1.7517		1.7537	1.0861
H15	4.8474	3.9060	4.8479	3.9062	2.5596	3.5536	2.8559	3.5533	2.5589	2.8560	3.0482	2.1680	1.7537	1.7537		1.0864
C16	4.7247	3.7304	4.7249	3.7305	2.6806	3.1015	2.5836	3.1010	2.6798	2.5834	2.1340	1.5240	1.0861	1.0861	1.0864

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	C2	C4	124.980	H1	C2	C7	123.059
C2	C4	H3	124.977	C2	C4	C10	111.905
C2	C7	H5	110.411	C2	C7	H6	113.136
C2	C7	C12	103.079	H3	C4	C10	123.077
C4	C2	C7	111.919	C4	C10	H8	113.191
C4	C10	H9	110.354	C4	C10	C12	103.085
H5	C7	H6	106.518	H5	C7	C12	111.686
H6	C7	C12	112.121	C7	C12	C10	104.578
C7	C12	H11	107.031	C7	C12	C16	114.626
H8	C10	H9	106.523	H8	C10	C12	112.164
H9	C10	C12	111.631	C10	C12	H11	107.015
C10	C12	C16	114.627	H11	C12	C16	108.464
C12	C16	H13	111.324	C12	C16	H14	111.317
C12	C16	H15	111.201	H13	C16	H14	107.500
H13	C16	H15	107.654	H14	C16	H15	107.655

All results from a given calculation for C₆H₁₀ (Cyclopentene, 4-methyl-)

using model chemistry: HF/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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken	CHELPG	ESP
1	H	0.207	0.144	0.165
2	C	-0.210	-0.293	-0.291
3	H	0.207	0.144	0.165
4	C	-0.211	-0.294	-0.289
5	H	0.208	-0.042	0.028
6	H	0.214	-0.057	0.002
7	C	-0.411	0.243	0.065
8	H	0.214	-0.057	0.002
9	H	0.208	-0.042	0.028
10	C	-0.411	0.244	0.063
11	H	0.208	-0.043	0.009
12	C	-0.241	0.185	0.216
13	H	0.208	0.066	0.114
14	H	0.208	0.066	0.114
15	H	0.201	0.069	0.127
16	C	-0.599	-0.334	-0.518

	x	y	z	Total
	0.129	0.000	0.022	0.131
CHELPG
AIM
ESP	0.118	-0.002	0.007	0.118

	x	y	z
x	9.481	0.000	0.047
y	0.000	10.320	0.000
z	0.047	0.000	7.008

<r²>	163.856
(<r²>)^1/2	12.801

All results from a given calculation for C6H10 (Cyclopentene, 4-methyl-)

using model chemistry: HF/6-311G*

States and conformations

All results from a given calculation for C₆H₁₀ (Cyclopentene, 4-methyl-)