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	hartrees
Energy at 0K	-194.068721
Energy at 298.15K	-194.075896
HF Energy	-193.391333
Nuclear repulsion energy	162.909453

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3285	3184	7.75
2	A₁	3230	3131	7.00
3	A₁	3063	2969	36.65
4	A₁	1528	1481	0.30
5	A₁	1482	1436	4.77
6	A₁	1281	1241	0.52
7	A₁	1120	1085	3.58
8	A₁	1054	1022	0.04
9	A₁	932	904	2.77
10	A₁	816	790	0.14
11	A₂	3088	2993	0.00
12	A₂	1227	1189	0.00
13	A₂	987	957	0.00
14	A₂	632	613	0.00
15	A₂	63	61	0.00
16	B₁	3109	3013	31.04
17	B₁	1142	1107	5.09
18	B₁	979	949	6.70
19	B₁	808	783	5.36
20	B₁	619	600	68.19
21	B₁	427	414	7.95
22	B₂	3273	3173	4.43
23	B₂	3050	2956	29.10
24	B₂	1457	1412	1.43
25	B₂	1390	1347	4.01
26	B₂	1308	1268	0.88
27	B₂	1282	1243	5.74
28	B₂	1064	1032	0.47
29	B₂	912	884	20.32
30	B₂	721	699	0.04

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.269
C2	0.000	1.148	0.507
C3	0.000	-1.148	0.507
C4	0.000	0.775	-0.966
C5	0.000	-0.775	-0.966
H6	0.000	0.000	2.362
H7	0.000	2.214	0.729
H8	0.000	-2.214	0.729
H9	0.883	1.190	-1.480
H10	-0.883	1.190	-1.480
H11	0.883	-1.190	-1.480
H12	-0.883	-1.190	-1.480

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12
C1		1.3775	1.3775	2.3653	2.3653	1.0932	2.2792	2.2792	3.1229	3.1229	3.1229	3.1229
C2	1.3775		2.2959	1.5201	2.4222	2.1811	1.0893	3.3696	2.1753	2.1753	3.1932	3.1932
C3	1.3775	2.2959		2.4222	1.5201	2.1811	3.3696	1.0893	3.1932	3.1932	2.1753	2.1753
C4	2.3653	1.5201	2.4222		1.5490	3.4171	2.2242	3.4362	1.1033	1.1033	2.2146	2.2146
C5	2.3653	2.4222	1.5201	1.5490		3.4171	3.4362	2.2242	2.2146	2.2146	1.1033	1.1033
H6	1.0932	2.1811	2.1811	3.4171	3.4171		2.7513	2.7513	4.1180	4.1180	4.1180	4.1180
H7	2.2792	1.0893	3.3696	2.2242	3.4362	2.7513		4.4288	2.5903	2.5903	4.1535	4.1535
H8	2.2792	3.3696	1.0893	3.4362	2.2242	2.7513	4.4288		4.1535	4.1535	2.5903	2.5903
H9	3.1229	2.1753	3.1932	1.1033	2.2146	4.1180	2.5903	4.1535		1.7669	2.3803	2.9644
H10	3.1229	2.1753	3.1932	1.1033	2.2146	4.1180	2.5903	4.1535	1.7669		2.9644	2.3803
H11	3.1229	3.1932	2.1753	2.2146	1.1033	4.1180	4.1535	2.5903	2.3803	2.9644		1.7669
H12	3.1229	3.1932	2.1753	2.2146	1.1033	4.1180	4.1535	2.5903	2.9644	2.3803	1.7669

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	109.335	C1	C2	H7	134.702
C1	C3	C5	109.335	C1	C3	H8	134.702
C2	C1	C3	112.890	C2	C1	H6	123.555
C2	C4	C5	104.220	C2	C4	H9	111.032
C2	C4	H10	111.032	C3	C1	H6	123.555
C3	C5	C4	104.220	C3	C5	H11	111.032
C3	C5	H12	111.032	C4	C2	H7	115.963
C4	C5	H11	112.131	C4	C5	H12	112.131
C5	C3	H8	115.963	C5	C4	H9	112.131
C5	C4	H10	112.131	H9	C4	H10	106.403
H11	C5	H12	106.403

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

using model chemistry: MP2=FULL/aug-cc-pVDZ

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/aug-cc-pVDZ

States and conformations

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