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	hartrees
Energy at 0K	-31.478274
Energy at 298.15K	-31.485567
HF Energy	-31.478274
Nuclear repulsion energy	86.497844

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3376	3050	19.11
2	A₁	3335	3013	16.50
3	A₁	3186	2879	80.05
4	A₁	1638	1480	1.21
5	A₁	1558	1408	0.07
6	A₁	1415	1278	0.03
7	A₁	1149	1038	1.41
8	A₁	1084	979	0.62
9	A₁	960	867	1.00
10	A₁	850	768	0.02
11	A₂	3189	2881	0.00
12	A₂	1348	1218	0.00
13	A₂	1079	975	0.00
14	A₂	590	533	0.00
15	A₂	97	87	0.00
16	B₁	3215	2904	109.38
17	B₁	1233	1114	3.82
18	B₁	975	881	10.44
19	B₁	863	780	2.15
20	B₁	602	544	70.07
21	B₁	406	367	11.12
22	B₂	3366	3040	32.01
23	B₂	3167	2861	62.31
24	B₂	1610	1454	0.01
25	B₂	1505	1360	3.39
26	B₂	1423	1285	0.87
27	B₂	1410	1274	0.65
28	B₂	1131	1022	0.74
29	B₂	953	861	6.98
30	B₂	760	687	0.05

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.279
C2	0.000	1.153	0.508
C3	0.000	-1.153	0.508
C4	0.000	0.775	-0.971
C5	0.000	-0.775	-0.971
H6	0.000	0.000	2.358
H7	0.000	2.208	0.718
H8	0.000	-2.208	0.718
H9	0.872	1.183	-1.479
H10	-0.872	1.183	-1.479
H11	0.872	-1.183	-1.479
H12	-0.872	-1.183	-1.479

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12
C1		1.3872	1.3872	2.3799	2.3799	1.0786	2.2786	2.2786	3.1257	3.1257	3.1257	3.1257
C2	1.3872		2.3067	1.5269	2.4306	2.1795	1.0757	3.3683	2.1709	2.1709	3.1894	3.1894
C3	1.3872	2.3067		2.4306	1.5269	2.1795	3.3683	1.0757	3.1894	3.1894	2.1709	2.1709
C4	2.3799	1.5269	2.4306		1.5504	3.4177	2.2152	3.4286	1.0891	1.0891	2.2035	2.2035
C5	2.3799	2.4306	1.5269	1.5504		3.4177	3.4286	2.2152	2.2035	2.2035	1.0891	1.0891
H6	1.0786	2.1795	2.1795	3.4177	3.4177		2.7505	2.7505	4.1090	4.1090	4.1090	4.1090
H7	2.2786	1.0757	3.3683	2.2152	3.4286	2.7505		4.4168	2.5769	2.5769	4.1345	4.1345
H8	2.2786	3.3683	1.0757	3.4286	2.2152	2.7505	4.4168		4.1345	4.1345	2.5769	2.5769
H9	3.1257	2.1709	3.1894	1.0891	2.2035	4.1090	2.5769	4.1345		1.7449	2.3667	2.9404
H10	3.1257	2.1709	3.1894	1.0891	2.2035	4.1090	2.5769	4.1345	1.7449		2.9404	2.3667
H11	3.1257	3.1894	2.1709	2.2035	1.0891	4.1090	4.1345	2.5769	2.3667	2.9404		1.7449
H12	3.1257	3.1894	2.1709	2.2035	1.0891	4.1090	4.1345	2.5769	2.9404	2.3667	1.7449

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	109.414	C1	C2	H7	135.004
C1	C3	C5	109.414	C1	C3	H8	135.004
C2	C1	C3	112.495	C2	C1	H6	123.753
C2	C4	C5	104.339	C2	C4	H9	111.064
C2	C4	H10	111.064	C3	C1	H6	123.753
C3	C5	C4	104.339	C3	C5	H11	111.064
C3	C5	H12	111.064	C4	C2	H7	115.581
C4	C5	H11	112.008	C4	C5	H12	112.008
C5	C3	H8	115.581	C5	C4	H9	112.008
C5	C4	H10	112.008	H9	C4	H10	106.465
H11	C5	H12	106.465

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

using model chemistry: HF/CEP-121G*

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	-0.193
2	C	-0.229
3	C	-0.229
4	C	-0.331
5	C	-0.331
6	H	0.225
7	H	0.228
8	H	0.228
9	H	0.158
10	H	0.158
11	H	0.158
12	H	0.158

<r²>	84.615
(<r²>)^1/2	9.199

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

using model chemistry: HF/CEP-121G*

States and conformations

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