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	hartrees
Energy at 0K	-154.377438
Energy at 298.15K
HF Energy	-154.377438
Nuclear repulsion energy	74.008669

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3123	3001	23.62
2	A'	3049	2930	13.53
3	A'	2905	2791	28.90
4	A'	1510	1451	4.58
5	A'	1424	1368	21.23
6	A'	1403	1348	16.22
7	A'	1349	1296	8.03
8	A'	1105	1062	4.81
9	A'	1085	1042	14.97
10	A'	894	859	0.62
11	A'	429	412	6.91
12	A"	3134	3011	21.46
13	A"	2917	2802	9.53
14	A"	1501	1442	3.85
15	A"	1246	1197	0.24
16	A"	861	827	0.05
17	A"	255	245	12.55
18	A"	154i	148i	28.90

Atom	x (Å)	y (Å)	z (Å)
C1	1.045	-0.601	0.000
C2	0.000	0.513	0.000
O3	-1.306	0.099	0.000
H4	2.060	-0.188	0.000
H5	0.930	-1.232	0.886
H6	0.930	-1.232	-0.886
H7	0.130	1.193	0.867
H8	0.130	1.193	-0.867

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.5273	2.4534	1.0954	1.0939	1.0939	2.1927	2.1927
C2	1.5273		1.3703	2.1756	2.1668	2.1668	1.1099	1.1099
O3	2.4534	1.3703		3.3781	2.7491	2.7491	2.0030	2.0030
H4	1.0954	2.1756	3.3781		1.7755	1.7755	2.5264	2.5264
H5	1.0939	2.1668	2.7491	1.7755		1.7713	2.5540	3.0978
H6	1.0939	2.1668	2.7491	1.7755	1.7713		3.0978	2.5540
H7	2.1927	1.1099	2.0030	2.5264	2.5540	3.0978		1.7350
H8	2.1927	1.1099	2.0030	2.5264	3.0978	2.5540	1.7350

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	115.599	C1	C2	H7	111.513
C1	C2	H8	111.513	C2	C1	H4	111.025
C2	C1	H5	110.420	C2	C1	H6	110.420
O3	C2	H7	107.258	O3	C2	H8	107.258
H4	C1	H5	108.384	H4	C1	H6	108.384
H5	C1	H6	108.119	H7	C2	H8	102.809

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

using model chemistry: B3LYP/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	-0.327
2	C	0.042
3	O	-0.314
4	H	0.100
5	H	0.121
6	H	0.121
7	H	0.128
8	H	0.128

	x	y	z	Total
	1.871	0.629	0.000	1.974
CHELPG
AIM
ESP

	x	y	z
x	4.218	0.055	0.000
y	0.055	3.742	0.000
z	0.000	0.000	3.759

<r²>	51.136
(<r²>)^1/2	7.151

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

using model chemistry: B3LYP/6-31G**

States and conformations

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