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	hartrees
Energy at 0K	-194.063057
Energy at 298.15K
HF Energy	-193.386138
Nuclear repulsion energy	163.987378

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3329	3126	7.93
2	A₁	3274	3075	8.16
3	A₁	3113	2924	34.40
4	A₁	1560	1465	0.09
5	A₁	1538	1444	4.39
6	A₁	1328	1247	0.42
7	A₁	1149	1079	4.22
8	A₁	1073	1008	0.01
9	A₁	945	888	3.08
10	A₁	829	778	0.16
11	A₂	3140	2950	0.00
12	A₂	1244	1169	0.00
13	A₂	1024	961	0.00
14	A₂	635	596	0.00
15	A₂	15i	14i	0.00
16	B₁	3159	2967	32.07
17	B₁	1163	1092	5.45
18	B₁	986	926	7.08
19	B₁	834	783	4.42
20	B₁	625	587	82.40
21	B₁	421	396	10.73
22	B₂	3317	3116	6.14
23	B₂	3101	2913	31.50
24	B₂	1513	1421	1.05
25	B₂	1431	1344	7.03
26	B₂	1346	1264	0.03
27	B₂	1329	1249	6.71
28	B₂	1094	1028	0.35
29	B₂	931	874	18.82
30	B₂	733	689	0.05

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.262
C2	0.000	1.140	0.504
C3	0.000	-1.140	0.504
C4	0.000	0.770	-0.961
C5	0.000	-0.770	-0.961
H6	0.000	0.000	2.344
H7	0.000	2.195	0.728
H8	0.000	-2.195	0.728
H9	0.875	1.180	-1.472
H10	-0.875	1.180	-1.472
H11	0.875	-1.180	-1.472
H12	-0.875	-1.180	-1.472

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12
C1		1.3693	1.3693	2.3532	2.3532	1.0820	2.2590	2.2590	3.1036	3.1036	3.1036	3.1036
C2	1.3693		2.2808	1.5116	2.4080	2.1648	1.0780	3.3429	2.1612	2.1612	3.1710	3.1710
C3	1.3693	2.2808		2.4080	1.5116	2.1648	3.3429	1.0780	3.1710	3.1710	2.1612	2.1612
C4	2.3532	1.5116	2.4080		1.5405	3.3941	2.2099	3.4127	1.0927	1.0927	2.1978	2.1978
C5	2.3532	2.4080	1.5116	1.5405		3.3941	3.4127	2.2099	2.1978	2.1978	1.0927	1.0927
H6	1.0820	2.1648	2.1648	3.3941	3.3941		2.7258	2.7258	4.0889	4.0889	4.0889	4.0889
H7	2.2590	1.0780	3.3429	2.2099	3.4127	2.7258		4.3899	2.5755	2.5755	4.1226	4.1226
H8	2.2590	3.3429	1.0780	3.4127	2.2099	2.7258	4.3899		4.1226	4.1226	2.5755	2.5755
H9	3.1036	2.1612	3.1710	1.0927	2.1978	4.0889	2.5755	4.1226		1.7498	2.3606	2.9384
H10	3.1036	2.1612	3.1710	1.0927	2.1978	4.0889	2.5755	4.1226	1.7498		2.9384	2.3606
H11	3.1036	3.1710	2.1612	2.1978	1.0927	4.0889	4.1226	2.5755	2.3606	2.9384		1.7498
H12	3.1036	3.1710	2.1612	2.1978	1.0927	4.0889	4.1226	2.5755	2.9384	2.3606	1.7498

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	109.435	C1	C2	H7	134.408
C1	C3	C5	109.435	C1	C3	H8	134.408
C2	C1	C3	112.780	C2	C1	H6	123.610
C2	C4	C5	104.175	C2	C4	H9	111.156
C2	C4	H10	111.156	C3	C1	H6	123.610
C3	C5	C4	104.175	C3	C5	H11	111.156
C3	C5	H12	111.156	C4	C2	H7	116.156
C4	C5	H11	112.039	C4	C5	H12	112.039
C5	C3	H8	116.156	C5	C4	H9	112.039
C5	C4	H10	112.039	H9	C4	H10	106.391
H11	C5	H12	106.391

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

using model chemistry: MP2=FULL/6-31+G**

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/6-31+G**

States and conformations

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