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	hartrees
Energy at 0K	-31.397092
Energy at 298.15K	-31.404532
HF Energy	-31.397092
Nuclear repulsion energy	86.175709

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3362	3068	26.67
2	A₁	3320	3030	9.55
3	A₁	3157	2881	75.90
4	A₁	1643	1499	5.30
5	A₁	1549	1413	0.05
6	A₁	1400	1277	0.50
7	A₁	1163	1061	1.37
8	A₁	1088	993	2.10
9	A₁	959	875	2.45
10	A₁	861	786	0.01
11	A₂	3170	2892	0.00
12	A₂	1350	1232	0.00
13	A₂	1100	1003	0.00
14	A₂	620	566	0.00
15	A₂	122	111	0.00
16	B₁	3197	2917	109.43
17	B₁	1238	1130	3.41
18	B₁	985	899	10.51
19	B₁	879	802	0.94
20	B₁	615	561	84.19
21	B₁	422	385	9.49
22	B₂	3345	3052	35.39
23	B₂	3135	2861	62.38
24	B₂	1622	1480	0.81
25	B₂	1512	1379	4.38
26	B₂	1438	1312	0.49
27	B₂	1416	1292	2.02
28	B₂	1158	1057	1.06
29	B₂	963	879	8.85
30	B₂	775	708	0.02

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	1.287
C2	0.000	1.161	0.511
C3	0.000	-1.161	0.511
C4	0.000	0.778	-0.975
C5	0.000	-0.778	-0.975
H6	0.000	0.000	2.363
H7	0.000	2.216	0.713
H8	0.000	-2.216	0.713
H9	0.872	1.184	-1.484
H10	-0.872	1.184	-1.484
H11	0.872	-1.184	-1.484
H12	-0.872	-1.184	-1.484

	C1	C2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12
C1		1.3974	1.3974	2.3928	2.3928	1.0758	2.2897	2.2897	3.1376	3.1376	3.1376	3.1376
C2	1.3974		2.3230	1.5346	2.4433	2.1867	1.0743	3.3841	2.1773	2.1773	3.2002	3.2002
C3	1.3974	2.3230		2.4433	1.5346	2.1867	3.3841	1.0743	3.2002	3.2002	2.1773	2.1773
C4	2.3928	1.5346	2.4433		1.5561	3.4281	2.2182	3.4378	1.0884	1.0884	2.2066	2.2066
C5	2.3928	2.4433	1.5346	1.5561		3.4281	3.4378	2.2182	2.2066	2.2066	1.0884	1.0884
H6	1.0758	2.1867	2.1867	3.4281	3.4281		2.7632	2.7632	4.1189	4.1189	4.1189	4.1189
H7	2.2897	1.0743	3.3841	2.2182	3.4378	2.7632		4.4330	2.5799	2.5799	4.1416	4.1416
H8	2.2897	3.3841	1.0743	3.4378	2.2182	2.7632	4.4330		4.1416	4.1416	2.5799	2.5799
H9	3.1376	2.1773	3.2002	1.0884	2.2066	4.1189	2.5799	4.1416		1.7446	2.3679	2.9412
H10	3.1376	2.1773	3.2002	1.0884	2.2066	4.1189	2.5799	4.1416	1.7446		2.9412	2.3679
H11	3.1376	3.2002	2.1773	2.2066	1.0884	4.1189	4.1416	2.5799	2.3679	2.9412		1.7446
H12	3.1376	3.2002	2.1773	2.2066	1.0884	4.1189	4.1416	2.5799	2.9412	2.3679	1.7446

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	C4	109.307	C1	C2	H7	135.349
C1	C3	C5	109.307	C1	C3	H8	135.349
C2	C1	C3	112.446	C2	C1	H6	123.777
C2	C4	C5	104.470	C2	C4	H9	111.070
C2	C4	H10	111.070	C3	C1	H6	123.777
C3	C5	C4	104.470	C3	C5	H11	111.070
C3	C5	H12	111.070	C4	C2	H7	115.344
C4	C5	H11	111.899	C4	C5	H12	111.899
C5	C3	H8	115.344	C5	C4	H9	111.899
C5	C4	H10	111.899	H9	C4	H10	106.536
H11	C5	H12	106.536

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	-0.065
2	C	-0.176
3	C	-0.176
4	C	-0.357
5	C	-0.357
6	H	0.192
7	H	0.186
8	H	0.186
9	H	0.142
10	H	0.142
11	H	0.142
12	H	0.142

<r²>	85.308
(<r²>)^1/2	9.236

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)