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	hartrees
Energy at 0K	-194.296449
Energy at 298.15K	-194.303784
HF Energy	-193.435399
Nuclear repulsion energy	164.890996

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3304	3137	7.19
2	A₁	3245	3081	5.64
3	A₁	3087	2931	30.35
4	A₁	1551	1473	0.00
5	A₁	1510	1434	5.38
6	A₁	1299	1233	0.66
7	A₁	1141	1083	3.91
8	A₁	1066	1012	0.04
9	A₁	945	897	2.94
10	A₁	829	787	0.20
11	A₂	3095	2938	0.00
12	A₂	1248	1185	0.00
13	A₂	1011	960	0.00
14	A₂	688	653	0.00
15	A₂	84	80	0.00
16	B₁	3115	2958	27.71
17	B₁	1166	1107	4.84
18	B₁	1042	990	3.84
19	B₁	832	790	9.29
20	B₁	655	622	59.96
21	B₁	450	428	6.30
22	B₂	3289	3123	3.20
23	B₂	3076	2920	26.32
24	B₂	1488	1413	1.79
25	B₂	1415	1343	6.92
26	B₂	1333	1265	0.16
27	B₂	1304	1238	6.62
28	B₂	1079	1025	0.28
29	B₂	924	877	20.53
30	B₂	731	694	0.06

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.254
C2	0.000	1.133	0.501
C3	0.000	-1.133	0.501
C4	0.000	0.767	-0.956
C5	0.000	-0.767	-0.956
H6	0.000	0.000	2.330
H7	0.000	2.181	0.730
H8	0.000	-2.181	0.730
H9	0.871	1.176	-1.464
H10	-0.871	1.176	-1.464
H11	0.871	-1.176	-1.464
H12	-0.871	-1.176	-1.464

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12
C1		1.3602	1.3602	2.3395	2.3395	1.0762	2.2426	2.2426	3.0869	3.0869	3.0869	3.0869
C2	1.3602		2.2665	1.5031	2.3951	2.1513	1.0721	3.3218	2.1503	2.1503	3.1554	3.1554
C3	1.3602	2.2665		2.3951	1.5031	2.1513	3.3218	1.0721	3.1554	3.1554	2.1503	2.1503
C4	2.3395	1.5031	2.3951		1.5342	3.3747	2.2006	3.3962	1.0881	1.0881	2.1895	2.1895
C5	2.3395	2.3951	1.5031	1.5342		3.3747	3.3962	2.2006	2.1895	2.1895	1.0881	1.0881
H6	1.0762	2.1513	2.1513	3.3747	3.3747		2.7045	2.7045	4.0666	4.0666	4.0666	4.0666
H7	2.2426	1.0721	3.3218	2.2006	3.3962	2.7045		4.3613	2.5656	2.5656	4.1041	4.1041
H8	2.2426	3.3218	1.0721	3.3962	2.2006	2.7045	4.3613		4.1041	4.1041	2.5656	2.5656
H9	3.0869	2.1503	3.1554	1.0881	2.1895	4.0666	2.5656	4.1041		1.7421	2.3528	2.9276
H10	3.0869	2.1503	3.1554	1.0881	2.1895	4.0666	2.5656	4.1041	1.7421		2.9276	2.3528
H11	3.0869	3.1554	2.1503	2.1895	1.0881	4.0666	4.1041	2.5656	2.3528	2.9276		1.7421
H12	3.0869	3.1554	2.1503	2.1895	1.0881	4.0666	4.1041	2.5656	2.9276	2.3528	1.7421

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	109.481	C1	C2	H7	134.093
C1	C3	C5	109.481	C1	C3	H8	134.093
C2	C1	C3	112.842	C2	C1	H6	123.579
C2	C4	C5	104.099	C2	C4	H9	111.155
C2	C4	H10	111.155	C3	C1	H6	123.579
C3	C5	C4	104.099	C3	C5	H11	111.155
C3	C5	H12	111.155	C4	C2	H7	116.426
C4	C5	H11	112.095	C4	C5	H12	112.095
C5	C3	H8	116.426	C5	C4	H9	112.095
C5	C4	H10	112.095	H9	C4	H10	106.359
H11	C5	H12	106.359

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

using model chemistry: MP2=FULL/cc-pVTZ

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/cc-pVTZ

States and conformations

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