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	hartrees
Energy at 0K	-194.131899
Energy at 298.15K	-194.139087
HF Energy	-193.403550
Nuclear repulsion energy	163.775917

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3279	3105	8.62
2	A₁	3226	3055	9.37
3	A₁	3074	2911	33.61
4	A₁	1547	1465	0.58
5	A₁	1530	1449	5.17
6	A₁	1316	1246	1.09
7	A₁	1138	1078	4.47
8	A₁	1072	1015	0.01
9	A₁	945	895	3.53
10	A₁	827	783	0.19
11	A₂	3097	2933	0.00
12	A₂	1257	1190	0.00
13	A₂	1019	965	0.00
14	A₂	628	595	0.00
15	A₂	61	58	0.00
16	B₁	3117	2952	39.06
17	B₁	1177	1115	3.96
18	B₁	973	921	8.05
19	B₁	823	779	2.95
20	B₁	623	590	73.57
21	B₁	425	403	10.45
22	B₂	3267	3094	7.32
23	B₂	3063	2901	31.61
24	B₂	1506	1427	1.80
25	B₂	1410	1335	12.25
26	B₂	1330	1260	0.82
27	B₂	1311	1242	5.58
28	B₂	1078	1021	0.16
29	B₂	925	876	19.00
30	B₂	729	691	0.08

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.262
C2	0.000	1.141	0.505
C3	0.000	-1.141	0.505
C4	0.000	0.771	-0.962
C5	0.000	-0.771	-0.962
H6	0.000	0.000	2.349
H7	0.000	2.200	0.730
H8	0.000	-2.200	0.730
H9	0.877	1.184	-1.474
H10	-0.877	1.184	-1.474
H11	0.877	-1.184	-1.474
H12	-0.877	-1.184	-1.474

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12
C1		1.3694	1.3694	2.3542	2.3542	1.0865	2.2630	2.2630	3.1080	3.1080	3.1080	3.1080
C2	1.3694		2.2820	1.5133	2.4100	2.1681	1.0823	3.3482	2.1655	2.1655	3.1769	3.1769
C3	1.3694	2.2820		2.4100	1.5133	2.1681	3.3482	1.0823	3.1769	3.1769	2.1655	2.1655
C4	2.3542	1.5133	2.4100		1.5417	3.3995	2.2151	3.4189	1.0965	1.0965	2.2029	2.2029
C5	2.3542	2.4100	1.5133	1.5417		3.3995	3.4189	2.2151	2.2029	2.2029	1.0965	1.0965
H6	1.0865	2.1681	2.1681	3.3995	3.3995		2.7308	2.7308	4.0972	4.0972	4.0972	4.0972
H7	2.2630	1.0823	3.3482	2.2151	3.4189	2.7308		4.3993	2.5811	2.5811	4.1327	4.1327
H8	2.2630	3.3482	1.0823	3.4189	2.2151	2.7308	4.3993		4.1327	4.1327	2.5811	2.5811
H9	3.1080	2.1655	3.1769	1.0965	2.2029	4.0972	2.5811	4.1327		1.7541	2.3679	2.9468
H10	3.1080	2.1655	3.1769	1.0965	2.2029	4.0972	2.5811	4.1327	1.7541		2.9468	2.3679
H11	3.1080	3.1769	2.1655	2.2029	1.0965	4.0972	4.1327	2.5811	2.3679	2.9468		1.7541
H12	3.1080	3.1769	2.1655	2.2029	1.0965	4.0972	4.1327	2.5811	2.9468	2.3679	1.7541

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	109.407	C1	C2	H7	134.417
C1	C3	C5	109.407	C1	C3	H8	134.417
C2	C1	C3	112.868	C2	C1	H6	123.566
C2	C4	C5	104.159	C2	C4	H9	111.147
C2	C4	H10	111.147	C3	C1	H6	123.566
C3	C5	C4	104.159	C3	C5	H11	111.147
C3	C5	H12	111.147	C4	C2	H7	116.176
C4	C5	H11	112.133	C4	C5	H12	112.133
C5	C3	H8	116.176	C5	C4	H9	112.133
C5	C4	H10	112.133	H9	C4	H10	106.244
H11	C5	H12	106.244

All results from a given calculation for C₅H₇ (cyclopentenyl radical)

using model chemistry: MP2=FULL/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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All results from a given calculation for C5H7 (cyclopentenyl radical)

using model chemistry: MP2=FULL/6-311G*

States and conformations

All results from a given calculation for C₅H₇ (cyclopentenyl radical)