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	hartrees
Energy at 0K	-153.460936
Energy at 298.15K	-153.466078
HF Energy	-153.460936
Nuclear repulsion energy	74.260504

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3274	2915	41.26
2	A'	3210	2858	14.20
3	A'	3187	2838	36.70
4	A'	1642	1462	3.58
5	A'	1599	1424	7.72
6	A'	1569	1397	13.32
7	A'	1530	1362	9.93
8	A'	1208	1076	8.61
9	A'	1164	1036	32.94
10	A'	966	860	2.52
11	A'	456	406	6.59
12	A"	3286	2926	47.65
13	A"	3220	2867	17.90
14	A"	1629	1450	1.80
15	A"	1381	1229	0.88
16	A"	943	840	0.28
17	A"	299	266	16.42
18	A"	193	171	7.88

Atom	x (Å)	y (Å)	z (Å)
C1	1.048	-0.570	0.000
C2	0.000	0.532	0.000
O3	-1.302	0.052	0.000
H4	2.049	-0.148	0.000
H5	0.941	-1.197	0.878
H6	0.941	-1.197	-0.878
H7	0.097	1.176	0.872
H8	0.097	1.176	-0.872

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.5206	2.4307	1.0859	1.0845	1.0845	2.1703	2.1703
C2	1.5206		1.3876	2.1585	2.1554	2.1554	1.0880	1.0880
O3	2.4307	1.3876		3.3564	2.7132	2.7132	1.9951	1.9951
H4	1.0859	2.1585	3.3564		1.7602	1.7602	2.5138	2.5138
H5	1.0845	2.1554	2.7132	1.7602		1.7569	2.5179	3.0665
H6	1.0845	2.1554	2.7132	1.7602	1.7569		3.0665	2.5179
H7	2.1703	1.0880	1.9951	2.5138	2.5179	3.0665		1.7437
H8	2.1703	1.0880	1.9951	2.5138	3.0665	2.5179	1.7437

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	113.319	C1	C2	H7	111.527
C1	C2	H8	111.527	C2	C1	H4	110.704
C2	C1	H5	110.546	C2	C1	H6	110.546
O3	C2	H7	106.774	O3	C2	H8	106.774
H4	C1	H5	108.386	H4	C1	H6	108.386
H5	C1	H6	108.189	H7	C2	H8	106.517

All results from a given calculation for CH₃CH₂O (Ethoxy radical)

using model chemistry: ROHF/6-31G*

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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Number	Element	Mulliken
1	C	-0.496
2	C	-0.029
3	O	-0.341
4	H	0.158
5	H	0.174
6	H	0.174
7	H	0.180
8	H	0.180

	x	y	z	Total
	1.846	0.664	0.000	1.962
CHELPG
AIM
ESP

<r²>	50.810
(<r²>)^1/2	7.128

All results from a given calculation for CH3CH2O (Ethoxy radical)

using model chemistry: ROHF/6-31G*

States and conformations

All results from a given calculation for CH₃CH₂O (Ethoxy radical)