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	hartrees
Energy at 0K	-194.730270
Energy at 298.15K	-194.739288
HF Energy	-193.990423
Nuclear repulsion energy	170.295682

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3242	3101	20.38
2	A'	3144	3008	41.95
3	A'	3115	2980	36.37
4	A'	3082	2949	20.25
5	A'	3052	2920	27.45
6	A'	1707	1633	1.34
7	A'	1509	1444	0.85
8	A'	1481	1417	1.59
9	A'	1351	1292	0.14
10	A'	1242	1189	1.18
11	A'	1128	1080	0.10
12	A'	1078	1031	6.35
13	A'	993	950	0.93
14	A'	932	892	0.37
15	A'	842	806	0.50
16	A'	720	688	29.68
17	A'	598	572	7.16
18	A'	180	172	0.10
19	A"	3215	3076	6.08
20	A"	3113	2978	24.45
21	A"	3054	2922	52.41
22	A"	1491	1426	0.75
23	A"	1396	1336	1.09
24	A"	1345	1286	1.07
25	A"	1311	1254	0.58
26	A"	1238	1185	0.00
27	A"	1153	1103	1.43
28	A"	1058	1012	1.33
29	A"	964	922	0.15
30	A"	935	894	5.87
31	A"	901	862	1.01
32	A"	779	746	0.16
33	A"	389	373	0.05

Atom	x (Å)	y (Å)	z (Å)
C1	0.321	-1.189	0.000
C2	-0.083	-0.338	1.233
C3	-0.083	-0.338	-1.233
C4	-0.083	1.076	0.674
C5	-0.083	1.076	-0.674
H6	1.419	-1.319	0.000
H7	-0.135	-2.194	0.000
H8	-1.095	-0.604	1.600
H9	-1.095	-0.604	-1.600
H10	-0.128	1.972	1.302
H11	-0.128	1.972	-1.302
H12	0.611	-0.470	-2.083
H13	0.611	-0.470	2.083

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13
C1		1.5513	1.5513	2.3975	2.3975	1.1057	1.1034	2.2150	2.2150	3.4486	3.4486	2.2228	2.2228
C2	1.5513		2.4657	1.5210	2.3738	2.1762	2.2287	1.1091	3.0200	2.3121	3.4305	3.3903	1.1050
C3	1.5513	2.4657		2.3738	1.5210	2.1762	2.2287	3.0200	1.1091	3.4305	2.3121	1.1050	3.3903
C4	2.3975	1.5210	2.3738		1.3472	2.9061	3.3394	2.1691	3.0027	1.0957	2.1702	3.2360	2.2043
C5	2.3975	2.3738	1.5210	1.3472		2.9061	3.3394	3.0027	2.1691	2.1702	1.0957	2.2043	3.2360
H6	1.1057	2.1762	2.1762	2.9061	2.9061		1.7829	3.0642	3.0642	3.8631	3.8631	2.3902	2.3902
H7	1.1034	2.2287	2.2287	3.3394	3.3394	1.7829		2.4518	2.4518	4.3654	4.3654	2.8049	2.8049
H8	2.2150	1.1091	3.0200	2.1691	3.0027	3.0642	2.4518		3.2001	2.7676	3.9994	4.0611	1.7776
H9	2.2150	3.0200	1.1091	3.0027	2.1691	3.0642	2.4518	3.2001		3.9994	2.7676	1.7776	4.0611
H10	3.4486	2.3121	3.4305	1.0957	2.1702	3.8631	4.3654	2.7676	3.9994		2.6047	4.2396	2.6687
H11	3.4486	3.4305	2.3121	2.1702	1.0957	3.8631	4.3654	3.9994	2.7676	2.6047		2.6687	4.2396
H12	2.2228	3.3903	1.1050	3.2360	2.2043	2.3902	2.8049	4.0611	1.7776	4.2396	2.6687		4.1664
H13	2.2228	1.1050	3.3903	2.2043	3.2360	2.3902	2.8049	1.7776	4.0611	2.6687	4.2396	4.1664

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	102.584	C1	C2	H8	111.652
C1	C2	H13	112.519	C1	C3	C5	102.584
C1	C3	H9	111.652	C1	C3	H12	112.519
C2	C1	C3	105.259	C2	C1	H6	108.820
C2	C1	H7	113.102	C2	C4	C5	111.575
C2	C4	H10	123.341	C3	C1	H6	108.820
C3	C1	H7	113.102	C3	C5	C4	111.575
C3	C5	H11	123.341	C4	C2	H8	110.141
C4	C2	H13	113.209	C4	C5	H11	125.017
C5	C3	H9	110.141	C5	C3	H12	113.209
C5	C4	H10	125.017	H6	C1	H7	107.619
H8	C2	H13	106.813	H9	C3	H12	106.813

All results from a given calculation for C₅H₈ (Cyclopentene)

using model chemistry: CCD/cc-pVDZ

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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All results from a given calculation for C5H8 (Cyclopentene)

using model chemistry: CCD/cc-pVDZ

States and conformations

All results from a given calculation for C₅H₈ (Cyclopentene)