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	hartrees
Energy at 0K	-32.341982
Energy at 298.15K	-32.349158
HF Energy	-32.341982
Nuclear repulsion energy	85.313117

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3230	3128	20.36
2	A₁	3174	3074	10.24
3	A₁	3025	2929	64.16
4	A₁	1504	1456	7.58
5	A₁	1473	1426	0.62
6	A₁	1281	1241	1.85
7	A₁	1101	1066	4.51
8	A₁	1042	1009	0.77
9	A₁	907	878	5.71
10	A₁	798	773	0.04
11	A₂	3037	2941	0.00
12	A₂	1225	1186	0.00
13	A₂	992	961	0.00
14	A₂	649	628	0.00
15	A₂	93	90	0.00
16	B₁	3065	2968	114.42
17	B₁	1134	1098	4.75
18	B₁	983	952	7.88
19	B₁	808	782	1.85
20	B₁	625	605	118.27
21	B₁	412	399	10.54
22	B₂	3213	3111	21.96
23	B₂	3008	2912	51.67
24	B₂	1484	1437	1.97
25	B₂	1425	1380	3.88
26	B₂	1313	1272	11.01
27	B₂	1310	1268	0.00
28	B₂	1087	1053	1.31
29	B₂	915	886	18.31
30	B₂	714	691	0.00

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.296
C2	0.000	1.172	0.515
C3	0.000	-1.172	0.515
C4	0.000	0.785	-0.981
C5	0.000	-0.785	-0.981
H6	0.000	0.000	2.389
H7	0.000	2.244	0.715
H8	0.000	-2.244	0.715
H9	0.886	1.199	-1.500
H10	-0.886	1.199	-1.500
H11	0.886	-1.199	-1.500
H12	-0.886	-1.199	-1.500

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12
C1		1.4084	1.4084	2.4081	2.4081	1.0929	2.3183	2.3183	3.1687	3.1687	3.1687	3.1687
C2	1.4084		2.3441	1.5449	2.4631	2.2102	1.0910	3.4224	2.2014	2.2014	3.2356	3.2356
C3	1.4084	2.3441		2.4631	1.5449	2.2102	3.4224	1.0910	3.2356	3.2356	2.2014	2.2014
C4	2.4081	1.5449	2.4631		1.5700	3.4597	2.2376	3.4719	1.1073	1.1073	2.2343	2.2343
C5	2.4081	2.4631	1.5449	1.5700		3.4597	3.4719	2.2376	2.2343	2.2343	1.1073	1.1073
H6	1.0929	2.2102	2.2102	3.4597	3.4597		2.7996	2.7996	4.1650	4.1650	4.1650	4.1650
H7	2.3183	1.0910	3.4224	2.2376	3.4719	2.7996		4.4889	2.6050	2.6050	4.1897	4.1897
H8	2.3183	3.4224	1.0910	3.4719	2.2376	2.7996	4.4889		4.1897	4.1897	2.6050	2.6050
H9	3.1687	2.2014	3.2356	1.1073	2.2343	4.1650	2.6050	4.1897		1.7715	2.3987	2.9820
H10	3.1687	2.2014	3.2356	1.1073	2.2343	4.1650	2.6050	4.1897	1.7715		2.9820	2.3987
H11	3.1687	3.2356	2.2014	2.2343	1.1073	4.1650	4.1897	2.6050	2.3987	2.9820		1.7715
H12	3.1687	3.2356	2.2014	2.2343	1.1073	4.1650	4.1897	2.6050	2.9820	2.3987	1.7715

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	109.164	C1	C2	H7	135.737
C1	C3	C5	109.164	C1	C3	H8	135.737
C2	C1	C3	112.653	C2	C1	H6	123.673
C2	C4	C5	104.510	C2	C4	H9	111.128
C2	C4	H10	111.128	C3	C1	H6	123.673
C3	C5	C4	104.510	C3	C5	H11	111.128
C3	C5	H12	111.128	C4	C2	H7	115.100
C4	C5	H11	111.976	C4	C5	H12	111.976
C5	C3	H8	115.100	C5	C4	H9	111.976
C5	C4	H10	111.976	H9	C4	H10	106.242
H11	C5	H12	106.242

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

using model chemistry: B3LYP/CEP-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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Number	Element	Mulliken
1	C	-0.212
2	C	-0.357
3	C	-0.357
4	C	-0.240
5	C	-0.240
6	H	0.288
7	H	0.286
8	H	0.286
9	H	0.136
10	H	0.136
11	H	0.136
12	H	0.136

<r²>	86.061
(<r²>)^1/2	9.277

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

using model chemistry: B3LYP/CEP-31G

States and conformations

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