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	hartrees
Energy at 0K	-78.962537
Energy at 298.15K	-78.966409
HF Energy	-78.630420
Nuclear repulsion energy	37.087262

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3233	3233	12.06
2	A'	3141	3141	21.45
3	A'	3065	3065	24.15
4	A'	1535	1535	1.99
5	A'	1520	1520	3.71
6	A'	1449	1449	0.82
7	A'	1091	1091	0.02
8	A'	1016	1016	0.40
9	A'	472	472	55.06
10	A"	3337	3337	11.54
11	A"	3182	3182	20.11
12	A"	1533	1533	4.92
13	A"	1236	1236	1.83
14	A"	831	831	1.19
15	A"	135	135	0.11

Atom	x (Å)	y (Å)	z (Å)
C1	-0.011	-0.695	0.000
C2	-0.011	0.794	0.000
H3	1.004	-1.097	0.000
H4	-0.509	-1.092	0.880
H5	-0.509	-1.092	-0.880
H6	0.074	1.343	-0.920
H7	0.074	1.343	0.920

	C1	C2	H3	H4	H5	H6	H7
C1		1.4884	1.0921	1.0859	1.0859	2.2376	2.2376
C2	1.4884		2.1457	2.1393	2.1393	1.0751	1.0751
H3	1.0921	2.1457		1.7503	1.7503	2.7684	2.7684
H4	1.0859	2.1393	1.7503		1.7596	3.0835	2.5039
H5	1.0859	2.1393	1.7503	1.7596		2.5039	3.0835
H6	2.2376	1.0751	2.7684	3.0835	2.5039		1.8405
H7	2.2376	1.0751	2.7684	2.5039	3.0835	1.8405

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	120.731	C1	C2	H7	120.731
C2	C1	H3	111.589	C2	C1	H4	111.444
C2	C1	H5	111.444	H3	C1	H4	106.950
H3	C1	H5	106.950	H4	C1	H5	108.227
H6	C2	H7	117.724

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

using model chemistry: CISD/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: CISD/Def2TZVPP

States and conformations

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