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	hartrees
Energy at 0K	-116.106574
Energy at 298.15K	-116.110817
HF Energy	-115.821686
Nuclear repulsion energy	64.306151

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	3204	3174
2	A₁	3113	3083
3	A₁	3102	3073
4	A₁	1559	1545
5	A₁	1285	1273
6	A₁	1036	1026
7	A₁	445	441
8	A₂	759	752
9	A₂	548	543
10	B₁	985	976
11	B₁	770	763
12	B₁	525	520
13	B₂	3200	3170
14	B₂	3107	3077
15	B₂	1532	1518
16	B₂	1459	1445
17	B₂	1168	1157
18	B₂	973	964

Atom	y (Å)	z (Å)
C1	0.000	0.453
H2	0.000	1.548
C3	1.239	-0.200
C4	-1.239	-0.200
H5	2.178	0.353
H6	-2.178	0.353
H7	1.302	-1.289
H8	-1.302	-1.289

	C1	H2	C3	C4	H5	H6	H7	H8
C1		1.0945	1.4004	1.4004	2.1798	2.1798	2.1754	2.1754
H2	1.0945		2.1420	2.1420	2.4836	2.4836	3.1217	3.1217
C3	1.4004	2.1420		2.4778	1.0893	3.4608	1.0917	2.7649
C4	1.4004	2.1420	2.4778		3.4608	1.0893	2.7649	1.0917
H5	2.1798	2.4836	1.0893	3.4608		4.3550	1.8613	3.8479
H6	2.1798	2.4836	3.4608	1.0893	4.3550		3.8479	1.8613
H7	2.1754	3.1217	1.0917	2.7649	1.8613	3.8479		2.6043
H8	2.1754	3.1217	2.7649	1.0917	3.8479	1.8613	2.6043

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C3	H5	121.716	C1	C3	H7	121.108
C1	C4	H6	121.716	C1	C4	H8	121.108
H2	C1	C3	117.787	H2	C1	C4	117.787
C3	C1	C4	124.426	H5	C3	H7	117.176
H6	C4	H8	117.176

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

using model chemistry: CCSD(T)/3-21G

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)/3-21G

States and conformations

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