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	hartrees
Energy at 0K	-193.404134
Energy at 298.15K	-193.411491
HF Energy	-193.404134
Nuclear repulsion energy	163.591609

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3375	3052	17.31
2	A₁	3331	3012	17.25
3	A₁	3180	2876	72.95
4	A₁	1638	1481	1.66
5	A₁	1574	1424	0.03
6	A₁	1416	1280	0.01
7	A₁	1160	1049	1.79
8	A₁	1091	987	0.55
9	A₁	964	872	1.04
10	A₁	860	778	0.06
11	A₂	3175	2872	0.00
12	A₂	1357	1227	0.00
13	A₂	1087	983	0.00
14	A₂	603	546	0.00
15	A₂	106	96	0.00
16	B₁	3202	2896	100.20
17	B₁	1247	1128	2.95
18	B₁	981	887	9.09
19	B₁	873	789	1.91
20	B₁	608	550	62.98
21	B₁	418	378	9.61
22	B₂	3364	3043	30.06
23	B₂	3161	2859	56.86
24	B₂	1610	1456	0.19
25	B₂	1520	1375	4.62
26	B₂	1433	1296	1.45
27	B₂	1422	1286	1.05
28	B₂	1142	1032	0.67
29	B₂	960	868	7.41
30	B₂	771	697	0.07

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.271
C2	0.000	1.146	0.505
C3	0.000	-1.146	0.505
C4	0.000	0.771	-0.965
C5	0.000	-0.771	-0.965
H6	0.000	0.000	2.347
H7	0.000	2.197	0.720
H8	0.000	-2.197	0.720
H9	0.870	1.180	-1.474
H10	-0.870	1.180	-1.474
H11	0.870	-1.180	-1.474
H12	-0.870	-1.180	-1.474

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12
C1		1.3781	1.3781	2.3654	2.3654	1.0764	2.2652	2.2652	3.1116	3.1116	3.1116	3.1116
C2	1.3781		2.2918	1.5174	2.4162	2.1693	1.0731	3.3501	2.1622	2.1622	3.1752	3.1752
C3	1.3781	2.2918		2.4162	1.5174	2.1693	3.3501	1.0731	3.1752	3.1752	2.1622	2.1622
C4	2.3654	1.5174	2.4162		1.5427	3.4011	2.2077	3.4137	1.0872	1.0872	2.1957	2.1957
C5	2.3654	2.4162	1.5174	1.5427		3.4011	3.4137	2.2077	2.1957	2.1957	1.0872	1.0872
H6	1.0764	2.1693	2.1693	3.4011	3.4011		2.7340	2.7340	4.0927	4.0927	4.0927	4.0927
H7	2.2652	1.0731	3.3501	2.2077	3.4137	2.7340		4.3945	2.5705	2.5705	4.1200	4.1200
H8	2.2652	3.3501	1.0731	3.4137	2.2077	2.7340	4.3945		4.1200	4.1200	2.5705	2.5705
H9	3.1116	2.1622	3.1752	1.0872	2.1957	4.0927	2.5705	4.1200		1.7395	2.3590	2.9310
H10	3.1116	2.1622	3.1752	1.0872	2.1957	4.0927	2.5705	4.1200	1.7395		2.9310	2.3590
H11	3.1116	3.1752	2.1622	2.1957	1.0872	4.0927	4.1200	2.5705	2.3590	2.9310		1.7395
H12	3.1116	3.1752	2.1622	2.1957	1.0872	4.0927	4.1200	2.5705	2.9310	2.3590	1.7395

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	109.456	C1	C2	H7	134.692
C1	C3	C5	109.456	C1	C3	H8	134.692
C2	C1	C3	112.504	C2	C1	H6	123.748
C2	C4	C5	104.292	C2	C4	H9	111.154
C2	C4	H10	111.154	C3	C1	H6	123.748
C3	C5	C4	104.292	C3	C5	H11	111.154
C3	C5	H12	111.154	C4	C2	H7	115.851
C4	C5	H11	112.052	C4	C5	H12	112.052
C5	C3	H8	115.851	C5	C4	H9	112.052
C5	C4	H10	112.052	H9	C4	H10	106.258
H11	C5	H12	106.258

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

using model chemistry: HF/6-311G*

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	-0.204
2	C	-0.216
3	C	-0.216
4	C	-0.432
5	C	-0.432
6	H	0.211
7	H	0.218
8	H	0.218
9	H	0.213
10	H	0.213
11	H	0.213
12	H	0.213

<r²>	99.656
(<r²>)^1/2	9.983

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

using model chemistry: HF/6-311G*

States and conformations

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