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	hartrees
Energy at 0K	-116.712423
Energy at 298.15K	-116.716620
HF Energy	-116.427595
Nuclear repulsion energy	64.011458

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3207	3025
2	A₁	3111	2934
3	A₁	3095	2919
4	A₁	1545	1457
5	A₁	1282	1209
6	A₁	1037	978
7	A₁	432	407
8	A₂	749	707
9	A₂	534	504
10	B₁	969	914
11	B₁	759	716
12	B₁	517	488
13	B₂	3203	3021
14	B₂	3105	2928
15	B₂	1524	1437
16	B₂	1450	1368
17	B₂	1200	1132
18	B₂	955	901

Atom	y (Å)	z (Å)
C1	0.000	0.453
H2	0.000	1.552
C3	1.246	-0.200
C4	-1.246	-0.200
H5	2.187	0.355
H6	-2.187	0.355
H7	1.315	-1.293
H8	-1.315	-1.293

	C1	H2	C3	C4	H5	H6	H7	H8
C1		1.0984	1.4070	1.4070	2.1896	2.1896	2.1860	2.1860
H2	1.0984		2.1498	2.1498	2.4933	2.4933	3.1340	3.1340
C3	1.4070	2.1498		2.4923	1.0927	3.4782	1.0953	2.7845
C4	1.4070	2.1498	2.4923		3.4782	1.0927	2.7845	1.0953
H5	2.1896	2.4933	1.0927	3.4782		4.3748	1.8650	3.8706
H6	2.1896	2.4933	3.4782	1.0927	4.3748		3.8706	1.8650
H7	2.1860	3.1340	1.0953	2.7845	1.8650	3.8706		2.6295
H8	2.1860	3.1340	2.7845	1.0953	3.8706	1.8650	2.6295

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	121.807	C1	C3	H7	121.254
C1	C4	H6	121.807	C1	C4	H8	121.254
H2	C1	C3	117.665	H2	C1	C4	117.665
C3	C1	C4	124.671	H5	C3	H7	116.940
H6	C4	H8	116.940

All results from a given calculation for C₃H₅ (Allyl radical)

using model chemistry: CCSD(T)/6-31G

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 C3H5 (Allyl radical)

using model chemistry: CCSD(T)/6-31G

States and conformations

All results from a given calculation for C₃H₅ (Allyl radical)