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	hartrees
Energy at 0K	-78.989802
Energy at 298.15K	-78.993652
HF Energy	-78.630325
Nuclear repulsion energy	36.986389

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3194	3194	11.74
2	A'	3099	3099	19.69
3	A'	3023	3023	22.46
4	A'	1513	1513	1.61
5	A'	1497	1497	4.02
6	A'	1426	1426	0.87
7	A'	1080	1080	0.01
8	A'	1000	1000	0.43
9	A'	474	474	55.45
10	A"	3298	3298	10.41
11	A"	3140	3140	18.53
12	A"	1509	1509	4.86
13	A"	1216	1216	1.78
14	A"	820	820	1.20
15	A"	129	129	0.08

Atom	x (Å)	y (Å)	z (Å)
C1	-0.011	-0.696	0.000
C2	-0.011	0.795	0.000
H3	1.009	-1.099	0.000
H4	-0.510	-1.095	0.883
H5	-0.510	-1.095	-0.883
H6	0.069	1.347	-0.923
H7	0.069	1.347	0.923

	C1	C2	H3	H4	H5	H6	H7
C1		1.4914	1.0959	1.0897	1.0897	2.2434	2.2434
C2	1.4914		2.1510	2.1450	2.1450	1.0786	1.0786
H3	1.0959	2.1510		1.7562	1.7562	2.7780	2.7780
H4	1.0897	2.1450	1.7562		1.7658	3.0919	2.5097
H5	1.0897	2.1450	1.7562	1.7658		2.5097	3.0919
H6	2.2434	1.0786	2.7780	3.0919	2.5097		1.8468
H7	2.2434	1.0786	2.7780	2.5097	3.0919	1.8468

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	120.759	C1	C2	H7	120.759
C2	C1	H3	111.566	C2	C1	H4	111.460
C2	C1	H5	111.460	H3	C1	H4	106.939
H3	C1	H5	106.939	H4	C1	H5	108.241
H6	C2	H7	117.770

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

using model chemistry: CCD/Def2TZVPP

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: CCD/Def2TZVPP

States and conformations

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