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	hartrees
Energy at 0K	-154.317607
Energy at 298.15K	-154.322594
HF Energy	-154.317607
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3160	2998	22.86
2	A'	3079	2921	13.47
3	A'	2946	2794	28.57
4	A'	1525	1446	6.07
5	A'	1448	1373	29.78
6	A'	1423	1350	13.58
7	A'	1378	1307	6.80
8	A'	1125	1067	1.42
9	A'	1115	1058	17.78
10	A'	914	867	0.55
11	A'	436	413	7.01
12	A"	3169	3006	20.50
13	A"	2969	2816	10.09
14	A"	1518	1440	5.11
15	A"	1260	1196	0.43
16	A"	875	830	0.04
17	A"	280	266	29.87
18	A"	164	156	4.91

Atom	x (Å)	y (Å)	z (Å)
C1	1.049	-0.586	0.000
C2	0.000	0.521	0.000
O3	-1.305	0.078	0.000
H4	2.063	-0.169	0.000
H5	0.935	-1.216	0.887
H6	0.935	-1.216	-0.887
H7	0.107	1.185	0.875
H8	0.107	1.185	-0.875

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.5252	2.4464	1.0961	1.0940	1.0940	2.1888	2.1888
C2	1.5252		1.3784	2.1749	2.1629	2.1629	1.1040	1.1040
O3	2.4464	1.3784		3.3771	2.7347	2.7347	1.9967	1.9967
H4	1.0961	2.1749	3.3771		1.7768	1.7768	2.5344	2.5344
H5	1.0940	2.1629	2.7347	1.7768		1.7735	2.5401	3.0914
H6	1.0940	2.1629	2.7347	1.7768	1.7735		3.0914	2.5401
H7	2.1888	1.1040	1.9967	2.5344	2.5401	3.0914		1.7505
H8	2.1888	1.1040	1.9967	2.5344	3.0914	2.5401	1.7505

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	114.724	C1	C2	H7	111.709
C1	C2	H8	111.709	C2	C1	H4	111.083
C2	C1	H5	110.246	C2	C1	H6	110.246
O3	C2	H7	106.576	O3	C2	H8	106.576
H4	C1	H5	108.447	H4	C1	H6	108.447
H5	C1	H6	108.295	H7	C2	H8	104.896

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

using model chemistry: wB97X-D/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	-0.512
2	C	-0.085
3	O	-0.305
4	H	0.161
5	H	0.181
6	H	0.181
7	H	0.189
8	H	0.189

	x	y	z	Total
	1.904	0.656	0.000	2.014
CHELPG
AIM
ESP

	x	y	z
x	4.094	0.067	0.000
y	0.067	3.675	0.000
z	0.000	0.000	3.710

<r²>	50.844
(<r²>)^1/2	7.131

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

using model chemistry: wB97X-D/6-31G*

States and conformations

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