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	hartrees
Energy at 0K	-29.544519
Energy at 298.15K
HF Energy	-29.544519
Nuclear repulsion energy	43.233761

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3255	2940	57.65
2	A'	3188	2880	14.54
3	A'	3172	2866	49.25
4	A'	1628	1470	4.17
5	A'	1588	1435	9.18
6	A'	1556	1406	15.97
7	A'	1510	1364	12.78
8	A'	1193	1077	7.51
9	A'	1153	1042	39.64
10	A'	953	861	3.67
11	A'	449	406	6.82
12	A"	3269	2954	69.15
13	A"	3210	2900	20.63
14	A"	1614	1458	2.26
15	A"	1367	1235	0.38
16	A"	924	834	0.47
17	A"	264	239	5.25
18	A"	153i	139i	19.18

Atom	x (Å)	y (Å)	z (Å)
C1	1.056	-0.571	0.000
C2	0.000	0.535	0.000
O3	-1.311	0.050	0.000
H4	2.056	-0.141	0.000
H5	0.953	-1.199	0.880
H6	0.953	-1.199	-0.880
H7	0.096	1.179	0.874
H8	0.096	1.179	-0.874

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.5290	2.4475	1.0881	1.0863	1.0863	2.1792	2.1792
C2	1.5290		1.3979	2.1640	2.1650	2.1650	1.0902	1.0902
O3	2.4475	1.3979		3.3725	2.7313	2.7313	2.0044	2.0044
H4	1.0881	2.1640	3.3725		1.7638	1.7638	2.5198	2.5198
H5	1.0863	2.1650	2.7313	1.7638		1.7607	2.5274	3.0768
H6	1.0863	2.1650	2.7313	1.7638	1.7607		3.0768	2.5274
H7	2.1792	1.0902	2.0044	2.5198	2.5274	3.0768		1.7488
H8	2.1792	1.0902	2.0044	2.5198	3.0768	2.5274	1.7488

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	113.410	C1	C2	H7	111.510
C1	C2	H8	111.510	C2	C1	H4	110.429
C2	C1	H5	110.615	C2	C1	H6	110.615
O3	C2	H7	106.679	O3	C2	H8	106.679
H4	C1	H5	108.416	H4	C1	H6	108.416
H5	C1	H6	108.272	H7	C2	H8	106.648

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

using model chemistry: HF/CEP-121G*

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	-0.476
2	C	-0.075
3	O	-0.254
4	H	0.153
5	H	0.162
6	H	0.162
7	H	0.164
8	H	0.164

	x	y	z	Total
	1.907	0.688	0.000	2.027
CHELPG
AIM
ESP

	x	y	z
x	3.958	-0.012	0.000
y	-0.012	3.749	0.000
z	0.000	0.000	3.814

<r²>	44.394
(<r²>)^1/2	6.663

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

using model chemistry: HF/CEP-121G*

States and conformations

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