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	hartrees
Energy at 0K	-78.587579
Energy at 298.15K	-78.591412
HF Energy	-78.531722
Nuclear repulsion energy	36.798895

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3189	3189	13.25
2	A'	3092	3092	21.68
3	A'	3009	3009	21.58
4	A'	1570	1570	6.37
5	A'	1530	1530	0.35
6	A'	1483	1483	4.52
7	A'	1049	1049	0.94
8	A'	1029	1029	0.62
9	A'	456	456	62.88
10	A"	3294	3294	16.62
11	A"	3133	3133	18.63
12	A"	1579	1579	5.41
13	A"	1249	1249	3.61
14	A"	855	855	3.93
15	A"	119	119	0.13

Atom	x (Å)	y (Å)	z (Å)
C1	-0.011	-0.701	0.000
C2	-0.011	0.801	0.000
H3	1.013	-1.107	0.000
H4	-0.513	-1.098	0.887
H5	-0.513	-1.098	-0.887
H6	0.071	1.352	-0.927
H7	0.071	1.352	0.927

	C1	C2	H3	H4	H5	H6	H7
C1		1.5014	1.1014	1.0942	1.0942	2.2536	2.2536
C2	1.5014		2.1649	2.1550	2.1550	1.0818	1.0818
H3	1.1014	2.1649		1.7655	1.7655	2.7915	2.7915
H4	1.0942	2.1550	1.7655		1.7743	3.1038	2.5185
H5	1.0942	2.1550	1.7655	1.7743		2.5185	3.1038
H6	2.2536	1.0818	2.7915	3.1038	2.5185		1.8549
H7	2.2536	1.0818	2.7915	2.5185	3.1038	1.8549

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	120.617	C1	C2	H7	120.617
C2	C1	H3	111.640	C2	C1	H4	111.282
C2	C1	H5	111.282	H3	C1	H4	107.042
H3	C1	H5	107.042	H4	C1	H5	108.339
H6	C2	H7	118.026

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

using model chemistry: B2PLYP=FULL/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 C2H5 (Ethyl radical)

using model chemistry: B2PLYP=FULL/3-21G*

States and conformations

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