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	hartrees
Energy at 0K	-29.486198
Energy at 298.15K	-29.491468
HF Energy	-29.486198
Nuclear repulsion energy	42.862489

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3240	2957	55.23
2	A'	3166	2889	17.75
3	A'	3149	2873	43.27
4	A'	1635	1492	8.29
5	A'	1603	1463	4.93
6	A'	1561	1425	13.43
7	A'	1508	1376	11.89
8	A'	1202	1097	8.07
9	A'	1135	1035	33.23
10	A'	940	858	7.19
11	A'	443	405	8.66
12	A"	3258	2973	68.37
13	A"	3210	2929	7.33
14	A"	1622	1480	4.20
15	A"	1375	1255	0.47
16	A"	968	884	0.00
17	A"	367	335	22.80
18	A"	218	199	0.21

Atom	x (Å)	y (Å)	z (Å)
C1	1.079	-0.538	0.000
C2	0.000	0.546	0.000
O3	-1.333	0.001	0.000
H4	2.070	-0.089	0.000
H5	0.989	-1.168	0.879
H6	0.989	-1.168	-0.879
H7	0.069	1.186	0.876
H8	0.069	1.186	-0.876

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.5295	2.4715	1.0874	1.0853	1.0853	2.1823	2.1823
C2	1.5295		1.4397	2.1645	2.1649	2.1649	1.0876	1.0876
O3	2.4715	1.4397		3.4034	2.7439	2.7439	2.0341	2.0341
H4	1.0874	2.1645	3.4034		1.7623	1.7623	2.5289	2.5289
H5	1.0853	2.1649	2.7439	1.7623		1.7585	2.5277	3.0773
H6	1.0853	2.1649	2.7439	1.7623	1.7585		3.0773	2.5277
H7	2.1823	1.0876	2.0341	2.5289	2.5277	3.0773		1.7519
H8	2.1823	1.0876	2.0341	2.5289	3.0773	2.5277	1.7519

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	112.656	C1	C2	H7	111.887
C1	C2	H8	111.887	C2	C1	H4	110.469
C2	C1	H5	110.629	C2	C1	H6	110.629
O3	C2	H7	106.357	O3	C2	H8	106.357
H4	C1	H5	108.407	H4	C1	H6	108.407
H5	C1	H6	108.220	H7	C2	H8	107.305

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	-0.425
2	C	-0.101
3	O	-0.237
4	H	0.139
5	H	0.153
6	H	0.153
7	H	0.159
8	H	0.159

	x	y	z	Total
	2.302	0.882	0.000	2.465
CHELPG
AIM
ESP

	x	y	z
x	3.904	0.077	0.000
y	0.077	3.548	0.000
z	0.000	0.000	3.735

<r²>	45.051
(<r²>)^1/2	6.712

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)