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	hartrees
Energy at 0K	-234.443099
Energy at 298.15K	-234.454053
Nuclear repulsion energy	231.533265

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3140	3116	38.84
2	A	3110	3086	11.94
3	A	3034	3011	77.54
4	A	3028	3005	7.12
5	A	3026	3003	48.64
6	A	2985	2962	55.78
7	A	2967	2945	25.77
8	A	2958	2935	32.96
9	A	2933	2910	52.74
10	A	2894	2872	40.55
11	A	1630	1618	1.11
12	A	1508	1497	3.79
13	A	1506	1494	4.24
14	A	1504	1492	1.57
15	A	1493	1482	0.46
16	A	1418	1407	1.37
17	A	1362	1352	2.33
18	A	1327	1317	5.05
19	A	1312	1302	0.30
20	A	1298	1288	2.31
21	A	1292	1282	0.58
22	A	1212	1202	0.83
23	A	1182	1173	0.50
24	A	1135	1126	0.37
25	A	1109	1100	3.06
26	A	1095	1087	5.42
27	A	1049	1041	0.54
28	A	985	977	0.36
29	A	963	956	1.83
30	A	946	939	1.23
31	A	926	919	0.53
32	A	880	874	2.77
33	A	836	830	0.78
34	A	805	798	2.15
35	A	751	745	0.24
36	A	732	726	29.32
37	A	590	585	5.97
38	A	490	486	2.29
39	A	337	334	0.05
40	A	280	278	0.15
41	A	232	230	0.03
42	A	98	98	0.12

Atom	x (Å)	y (Å)	z (Å)
H1	-0.302	2.239	0.140
C2	0.100	1.222	0.113
H3	2.181	1.604	-0.391
C4	1.382	0.895	-0.161
H5	2.220	-0.857	0.837
H6	2.191	-1.010	-0.928
C7	1.625	-0.611	-0.066
H8	0.098	-2.051	0.719
H9	-0.138	-1.568	-0.977
C10	0.171	-1.203	0.020
H11	-0.948	-0.035	1.532
C12	-0.765	-0.002	0.436
H13	-2.761	0.853	0.034
H14	-2.711	-0.929	-0.022
H15	-2.024	0.027	-1.367
C16	-2.147	-0.013	-0.271

	H1	C2	H3	C4	H5	H6	C7	H8	H9	C10	H11	C12	H13	H14	H15	C16
H1		1.0938	2.6175	2.1754	4.0534	4.2324	3.4463	4.3474	3.9703	3.4756	2.7434	2.3069	2.8246	3.9833	3.1825	2.9397
C2	1.0938		2.1750	1.3508	3.0560	3.2309	2.3909	3.3289	3.0046	2.4272	2.1665	1.5333	2.8861	3.5427	2.8516	2.5926
H3	2.6175	2.1750		1.0932	2.7506	2.6689	2.3070	4.3516	3.9729	3.4767	4.0226	3.4563	5.0172	5.5218	4.5959	4.6219
C4	2.1754	1.3508	1.0932		2.1834	2.2072	1.5282	3.3322	3.0066	2.4285	3.0270	2.4023	4.1478	4.4832	3.7156	3.6452
H5	4.0534	3.0560	2.7506	2.1834		1.7714	1.1093	2.4383	3.0589	2.2332	3.3467	3.1316	5.3275	5.0063	4.8633	4.5837
H6	4.2324	3.2309	2.6689	2.2072	1.7714		1.1056	2.8600	2.3959	2.2400	4.1063	3.4088	5.3782	4.9861	4.3631	4.4997
C7	3.4463	2.3909	2.3070	1.5282	1.1093	1.1056		2.2413	2.2029	1.5721	3.0837	2.5174	4.6251	4.3479	3.9259	3.8244
H8	4.3474	3.3289	4.3516	3.3322	2.4383	2.8600	2.2413		1.7792	1.1023	2.4127	2.2421	4.1327	3.1144	3.6298	3.1897
H9	3.9703	3.0046	3.9729	3.0066	3.0589	2.3959	2.2029	1.7792		1.1054	3.0496	2.2003	3.7098	2.8175	2.5003	2.6365
C10	3.4756	2.4272	3.4767	2.4285	2.2332	2.2400	1.5721	1.1023	1.1054		2.2143	1.5785	3.5808	2.8952	2.8727	2.6213
H11	2.7434	2.1665	4.0226	3.0270	3.3467	4.1063	3.0837	2.4127	3.0496	2.2143		1.1120	2.5136	2.5147	3.0932	2.1649
C12	2.3069	1.5333	3.4563	2.4023	3.1316	3.4088	2.5174	2.2421	2.2003	1.5785	1.1120		2.2078	2.2037	2.1991	1.5516
H13	2.8246	2.8861	5.0172	4.1478	5.3275	5.3782	4.6251	4.1327	3.7098	3.5808	2.5136	2.2078		1.7841	1.7864	1.1047
H14	3.9833	3.5427	5.5218	4.4832	5.0063	4.9861	4.3479	3.1144	2.8175	2.8952	2.5147	2.2037	1.7841		1.7878	1.1045
H15	3.1825	2.8516	4.5959	3.7156	4.8633	4.3631	3.9259	3.6298	2.5003	2.8727	3.0932	2.1991	1.7864	1.7878		1.1044
C16	2.9397	2.5926	4.6219	3.6452	4.5837	4.4997	3.8244	3.1897	2.6365	2.6213	2.1649	1.5516	1.1047	1.1045	1.1044

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
H1	C2	C4	125.385	H1	C2	C12	121.939
C2	C4	H3	125.397	C2	C4	C7	112.144
C2	C12	C10	102.513	C2	C12	H11	108.930
C2	C12	C16	114.369	H3	C4	C7	122.423
C4	C2	C12	112.653	C4	C7	H5	110.747
C4	C7	H6	112.880	C4	C7	C10	103.117
H5	C7	H6	106.221	H5	C7	C10	111.624
H6	C7	C10	112.384	C7	C10	H8	112.684
C7	C10	H9	109.483	C7	C10	C12	106.077
H8	C10	H9	107.392	H8	C10	C12	112.291
H9	C10	C12	108.858	C10	C12	H11	109.552
C10	C12	C16	113.739	H11	C12	C16	107.590
C12	C16	H13	111.326	C12	C16	H14	111.008
C12	C16	H15	110.653	H13	C16	H14	107.719
H13	C16	H15	107.929	H14	C16	H15	108.066

All results from a given calculation for C₆H₁₀ (Cyclopentene, 3-methyl-)

using model chemistry: BLYP/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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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
1	H	0.089
2	C	-0.056
3	H	0.092
4	C	-0.077
5	H	0.120
6	H	0.114
7	C	-0.262
8	H	0.105
9	H	0.117
10	C	-0.232
11	H	0.109
12	C	-0.100
13	H	0.114
14	H	0.116
15	H	0.120
16	C	-0.368

	x	y	z	Total
	-0.008	-0.154	0.106	0.187
CHELPG
AIM
ESP

	x	y	z
x	0.000	0.000	0.000
y	0.000	0.000	0.000
z	0.000	0.000	0.000

<r²>	168.633
(<r²>)^1/2	12.986

All results from a given calculation for C6H10 (Cyclopentene, 3-methyl-)

using model chemistry: BLYP/6-31G

States and conformations

All results from a given calculation for C₆H₁₀ (Cyclopentene, 3-methyl-)