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	hartrees
Energy at 0K	-78.950894
Energy at 298.15K	-78.954746
HF Energy	-78.626141
Nuclear repulsion energy	37.063645

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3211	3029	11.38
2	A'	3119	2942	14.77
3	A'	3035	2863	18.64
4	A'	1510	1424	2.71
5	A'	1494	1409	3.56
6	A'	1418	1337	1.51
7	A'	1089	1027	0.04
8	A'	991	935	0.60
9	A'	468	442	56.93
10	A"	3323	3135	7.33
11	A"	3165	2986	13.99
12	A"	1509	1423	5.85
13	A"	1209	1141	1.91
14	A"	819	773	1.53
15	A"	131	124	0.02

Atom	x (Å)	y (Å)	z (Å)
C1	-0.012	-0.693	0.000
C2	-0.012	0.793	0.000
H3	1.007	-1.096	0.000
H4	-0.508	-1.095	0.882
H5	-0.508	-1.095	-0.882
H6	0.073	1.344	-0.922
H7	0.073	1.344	0.922

	C1	C2	H3	H4	H5	H6	H7
C1		1.4859	1.0955	1.0887	1.0887	2.2379	2.2379
C2	1.4859		2.1462	2.1416	2.1416	1.0777	1.0777
H3	1.0955	2.1462		1.7528	1.7528	2.7709	2.7709
H4	1.0887	2.1416	1.7528		1.7641	3.0888	2.5075
H5	1.0887	2.1416	1.7528	1.7641		2.5075	3.0888
H6	2.2379	1.0777	2.7709	3.0888	2.5075		1.8439
H7	2.2379	1.0777	2.7709	2.5075	3.0888	1.8439

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	120.781	C1	C2	H7	120.781
C2	C1	H3	111.594	C2	C1	H4	111.639
C2	C1	H5	111.639	H3	C1	H4	106.736
H3	C1	H5	106.736	H4	C1	H5	108.227
H6	C2	H7	117.629

All results from a given calculation for C₂H₅ (Ethyl radical)

using model chemistry: MP2/6-311+G(3df,2p)

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 C2H5 (Ethyl radical)

using model chemistry: MP2/6-311+G(3df,2p)

States and conformations

All results from a given calculation for C₂H₅ (Ethyl radical)