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	hartrees
Energy at 0K	-194.089523
Energy at 298.15K	-194.096708
HF Energy	-193.382280
Nuclear repulsion energy	163.212170

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3301	3108	9.77
2	A₁	3253	3062	11.84
3	A₁	3096	2914	40.56
4	A₁	1556	1465	1.21
5	A₁	1535	1445	0.30
6	A₁	1337	1259	0.01
7	A₁	1132	1066	1.74
8	A₁	1067	1004	0.01
9	A₁	940	885	1.58
10	A₁	821	773	0.18
11	A₂	3112	2930	0.00
12	A₂	1269	1194	0.00
13	A₂	1025	965	0.00
14	A₂	594	559	0.00
15	A₂	90	85	0.00
16	B₁	3131	2948	56.88
17	B₁	1175	1107	2.33
18	B₁	934	879	6.24
19	B₁	833	784	1.17
20	B₁	598	563	45.37
21	B₁	400	377	8.26
22	B₂	3290	3097	12.27
23	B₂	3083	2902	35.84
24	B₂	1532	1443	0.07
25	B₂	1457	1372	2.52
26	B₂	1359	1280	2.74
27	B₂	1346	1267	1.98
28	B₂	1108	1043	0.75
29	B₂	939	884	8.64
30	B₂	732	690	0.25

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.272
C2	0.000	1.149	0.505
C3	0.000	-1.149	0.505
C4	0.000	0.773	-0.965
C5	0.000	-0.773	-0.965
H6	0.000	0.000	2.355
H7	0.000	2.207	0.721
H8	0.000	-2.207	0.721
H9	0.876	1.182	-1.478
H10	-0.876	1.182	-1.478
H11	0.876	-1.182	-1.478
H12	-0.876	-1.182	-1.478

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12
C1		1.3808	1.3808	2.3663	2.3663	1.0831	2.2745	2.2745	3.1188	3.1188	3.1188	3.1188
C2	1.3808		2.2975	1.5177	2.4195	2.1771	1.0797	3.3624	2.1686	2.1686	3.1838	3.1838
C3	1.3808	2.2975		2.4195	1.5177	2.1771	3.3624	1.0797	3.1838	3.1838	2.1686	2.1686
C4	2.3663	1.5177	2.4195		1.5455	3.4085	2.2131	3.4233	1.0945	1.0945	2.2029	2.2029
C5	2.3663	2.4195	1.5177	1.5455		3.4085	3.4233	2.2131	2.2029	2.2029	1.0945	1.0945
H6	1.0831	2.1771	2.1771	3.4085	3.4085		2.7459	2.7459	4.1058	4.1058	4.1058	4.1058
H7	2.2745	1.0797	3.3624	2.2131	3.4233	2.7459		4.4134	2.5790	2.5790	4.1339	4.1339
H8	2.2745	3.3624	1.0797	3.4233	2.2131	2.7459	4.4134		4.1339	4.1339	2.5790	2.5790
H9	3.1188	2.1686	3.1838	1.0945	2.2029	4.1058	2.5790	4.1339		1.7511	2.3650	2.9427
H10	3.1188	2.1686	3.1838	1.0945	2.2029	4.1058	2.5790	4.1339	1.7511		2.9427	2.3650
H11	3.1188	3.1838	2.1686	2.2029	1.0945	4.1058	4.1339	2.5790	2.3650	2.9427		1.7511
H12	3.1188	3.1838	2.1686	2.2029	1.0945	4.1058	4.1339	2.5790	2.9427	2.3650	1.7511

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	109.359	C1	C2	H7	134.794
C1	C3	C5	109.359	C1	C3	H8	134.794
C2	C1	C3	112.593	C2	C1	H6	123.704
C2	C4	C5	104.345	C2	C4	H9	111.202
C2	C4	H10	111.202	C3	C1	H6	123.704
C3	C5	C4	104.345	C3	C5	H11	111.202
C3	C5	H12	111.202	C4	C2	H7	115.847
C4	C5	H11	111.985	C4	C5	H12	111.985
C5	C3	H8	115.847	C5	C4	H9	111.985
C5	C4	H10	111.985	H9	C4	H10	106.244
H11	C5	H12	106.244

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

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

using model chemistry: QCISD/6-31G**

States and conformations

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