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	hartrees
Energy at 0K	-194.099559
Energy at 298.15K	-194.106665
HF Energy	-193.403269
Nuclear repulsion energy	162.771104

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3228	3091	11.39
2	A₁	3182	3046	11.13
3	A₁	3032	2903	40.80
4	A₁	1530	1465	4.73
5	A₁	1505	1441	0.01
6	A₁	1318	1262	0.61
7	A₁	1113	1066	3.16
8	A₁	1057	1012	0.25
9	A₁	932	892	2.75
10	A₁	817	782	0.15
11	A₂	3043	2913	0.00
12	A₂	1255	1202	0.00
13	A₂	1012	969	0.00
14	A₂	578	553	0.00
15	A₂	75	72	0.00
16	B₁	3064	2933	53.53
17	B₁	1168	1118	2.94
18	B₁	906	868	10.08
19	B₁	813	778	1.08
20	B₁	582	557	64.31
21	B₁	401	384	10.77
22	B₂	3217	3080	13.10
23	B₂	3019	2890	35.66
24	B₂	1505	1441	1.14
25	B₂	1427	1366	5.08
26	B₂	1331	1274	4.61
27	B₂	1323	1267	2.22
28	B₂	1086	1039	0.92
29	B₂	927	887	12.63
30	B₂	727	696	0.06

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.274
C2	0.000	1.151	0.507
C3	0.000	-1.151	0.507
C4	0.000	0.774	-0.967
C5	0.000	-0.774	-0.967
H6	0.000	0.000	2.363
H7	0.000	2.216	0.722
H8	0.000	-2.216	0.722
H9	0.880	1.187	-1.482
H10	-0.880	1.187	-1.482
H11	0.880	-1.187	-1.482
H12	-0.880	-1.187	-1.482

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12
C1		1.3835	1.3835	2.3708	2.3708	1.0892	2.2833	2.2833	3.1270	3.1270	3.1270	3.1270
C2	1.3835		2.3028	1.5214	2.4246	2.1844	1.0858	3.3739	2.1750	2.1750	3.1934	3.1934
C3	1.3835	2.3028		2.4246	1.5214	2.1844	3.3739	1.0858	3.1934	3.1934	2.1750	2.1750
C4	2.3708	1.5214	2.4246		1.5477	3.4189	2.2207	3.4336	1.0999	1.0999	2.2101	2.2101
C5	2.3708	2.4246	1.5214	1.5477		3.4189	3.4336	2.2207	2.2101	2.2101	1.0999	1.0999
H6	1.0892	2.1844	2.1844	3.4189	3.4189		2.7572	2.7572	4.1192	4.1192	4.1192	4.1192
H7	2.2833	1.0858	3.3739	2.2207	3.4336	2.7572		4.4312	2.5864	2.5864	4.1485	4.1485
H8	2.2833	3.3739	1.0858	3.4336	2.2207	2.7572	4.4312		4.1485	4.1485	2.5864	2.5864
H9	3.1270	2.1750	3.1934	1.0999	2.2101	4.1192	2.5864	4.1485		1.7594	2.3742	2.9550
H10	3.1270	2.1750	3.1934	1.0999	2.2101	4.1192	2.5864	4.1485	1.7594		2.9550	2.3742
H11	3.1270	3.1934	2.1750	2.2101	1.0999	4.1192	4.1485	2.5864	2.3742	2.9550		1.7594
H12	3.1270	3.1934	2.1750	2.2101	1.0999	4.1192	4.1485	2.5864	2.9550	2.3742	1.7594

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	109.305	C1	C2	H7	134.892
C1	C3	C5	109.305	C1	C3	H8	134.892
C2	C1	C3	112.653	C2	C1	H6	123.673
C2	C4	C5	104.369	C2	C4	H9	111.120
C2	C4	H10	111.120	C3	C1	H6	123.673
C3	C5	C4	104.369	C3	C5	H11	111.120
C3	C5	H12	111.120	C4	C2	H7	115.804
C4	C5	H11	112.068	C4	C5	H12	112.068
C5	C3	H8	115.804	C5	C4	H9	112.068
C5	C4	H10	112.068	H9	C4	H10	106.216
H11	C5	H12	106.216

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

using model chemistry: QCISD/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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All results from a given calculation for C5H7 (cyclopentenyl radical)

using model chemistry: QCISD/6-311G*

States and conformations

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