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	hartrees
Energy at 0K	-78.908697
Energy at 298.15K	-78.912623
HF Energy	-78.626084
Nuclear repulsion energy	37.036780

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3224	3056	14.42
2	A'	3132	2968	20.46
3	A'	3046	2888	22.53
4	A'	1521	1442	0.86
5	A'	1495	1417	5.80
6	A'	1433	1358	1.16
7	A'	1089	1032	0.02
8	A'	1006	954	0.49
9	A'	480	455	60.93
10	A"	3336	3163	12.00
11	A"	3177	3012	19.21
12	A"	1514	1435	5.26
13	A"	1227	1163	1.59
14	A"	828	785	1.26
15	A"	166	157	0.29

Atom	x (Å)	y (Å)	z (Å)
C1	-0.014	-0.694	0.000
C2	-0.014	0.794	0.000
H3	1.005	-1.098	0.000
H4	-0.514	-1.092	0.883
H5	-0.514	-1.092	-0.883
H6	0.097	1.342	-0.923
H7	0.097	1.342	0.923

	C1	C2	H3	H4	H5	H6	H7
C1		1.4871	1.0965	1.0899	1.0899	2.2372	2.2372
C2	1.4871		2.1489	2.1413	2.1413	1.0787	1.0787
H3	1.0965	2.1489		1.7566	1.7566	2.7621	2.7621
H4	1.0899	2.1413	1.7566		1.7655	3.0911	2.5095
H5	1.0899	2.1413	1.7566	1.7655		2.5095	3.0911
H6	2.2372	1.0787	2.7621	3.0911	2.5095		1.8450
H7	2.2372	1.0787	2.7621	2.5095	3.0911	1.8450

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H6	120.530	C1	C2	H7	120.530
C2	C1	H3	111.664	C2	C1	H4	111.460
C2	C1	H5	111.460	H3	C1	H4	106.916
H3	C1	H5	106.916	H4	C1	H5	108.182
H6	C2	H7	117.568

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

using model chemistry: MP2/TZVP

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/TZVP

States and conformations

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