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	hartrees
Energy at 0K	-78.960415
Energy at 298.15K	-78.964281
HF Energy	-78.609191
Nuclear repulsion energy	37.015032

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3250	3250	9.42
2	A'	3164	3164	16.82
3	A'	3085	3085	17.18
4	A'	1535	1535	4.35
5	A'	1510	1510	1.22
6	A'	1446	1446	0.95
7	A'	1096	1096	0.04
8	A'	1014	1014	0.33
9	A'	450	450	47.69
10	A"	3358	3358	8.38
11	A"	3207	3207	14.02
12	A"	1541	1541	4.02
13	A"	1229	1229	2.47
14	A"	827	827	1.80
15	A"	144	144	0.21

Atom	x (Å)	y (Å)	z (Å)
C1	-0.014	-0.695	0.000
C2	-0.014	0.795	0.000
H3	1.003	-1.100	0.000
H4	-0.513	-1.095	0.881
H5	-0.513	-1.095	-0.881
H6	0.092	1.345	-0.922
H7	0.092	1.345	0.922

	C1	C2	H3	H4	H5	H6	H7
C1		1.4903	1.0946	1.0887	1.0887	2.2408	2.2408
C2	1.4903		2.1507	2.1440	2.1440	1.0781	1.0781
H3	1.0946	2.1507		1.7536	1.7536	2.7669	2.7669
H4	1.0887	2.1440	1.7536		1.7626	3.0928	2.5134
H5	1.0887	2.1440	1.7536	1.7626		2.5134	3.0928
H6	2.2408	1.0781	2.7669	3.0928	2.5134		1.8430
H7	2.2408	1.0781	2.7669	2.5134	3.0928	1.8430

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	120.645	C1	C2	H7	120.645
C2	C1	H3	111.698	C2	C1	H4	111.522
C2	C1	H5	111.522	H3	C1	H4	106.872
H3	C1	H5	106.872	H4	C1	H5	108.100
H6	C2	H7	117.464

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

using model chemistry: MP3=FULL/6-31G(2df,p)

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: MP3=FULL/6-31G(2df,p)

States and conformations

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