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	hartrees
Energy at 0K	-154.323101
Energy at 298.15K	-154.327981
HF Energy	-154.323101
Nuclear repulsion energy	73.478849

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3032	3016	23.98
2	A'	2964	2948	16.74
3	A'	2768	2753	33.56
4	A'	1460	1452	6.74
5	A'	1369	1362	17.13
6	A'	1337	1330	36.30
7	A'	1268	1261	15.41
8	A'	1062	1057	4.69
9	A'	1040	1035	20.74
10	A'	854	849	1.67
11	A'	424	422	7.74
12	A"	3045	3029	19.24
13	A"	2759	2744	5.44
14	A"	1451	1443	8.34
15	A"	1181	1175	0.02
16	A"	834	830	0.10
17	A"	267	266	28.00
18	A"	152	151	8.40

Atom	x (Å)	y (Å)	z (Å)
C1	1.053	-0.616	0.000
C2	0.000	0.505	0.000
O3	-1.318	0.119	0.000
H4	2.073	-0.194	0.000
H5	0.938	-1.252	0.892
H6	0.938	-1.252	-0.892
H7	0.139	1.205	0.868
H8	0.139	1.205	-0.868

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.5384	2.4822	1.1037	1.1016	1.1016	2.2149	2.2149
C2	1.5384		1.3733	2.1874	2.1828	2.1828	1.1232	1.1232
O3	2.4822	1.3733		3.4049	2.7866	2.7866	2.0132	2.0132
H4	1.1037	2.1874	3.4049		1.7898	1.7898	2.5397	2.5397
H5	1.1016	2.1828	2.7866	1.7898		1.7845	2.5838	3.1263
H6	1.1016	2.1828	2.7866	1.7898	1.7845		3.1263	2.5838
H7	2.2149	1.1232	2.0132	2.5397	2.5838	3.1263		1.7357
H8	2.2149	1.1232	2.0132	2.5397	3.1263	2.5838	1.7357

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	116.853	C1	C2	H7	111.693
C1	C2	H8	111.693	C2	C1	H4	110.687
C2	C1	H5	110.448	C2	C1	H6	110.448
O3	C2	H7	107.068	O3	C2	H8	107.068
H4	C1	H5	108.502	H4	C1	H6	108.502
H5	C1	H6	108.178	H7	C2	H8	101.184

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

using model chemistry: BLYP/6-31+G**

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	-0.406
2	C	-0.136
3	O	-0.248
4	H	0.141
5	H	0.162
6	H	0.162
7	H	0.163
8	H	0.163

	x	y	z	Total
	2.254	0.731	0.000	2.370
CHELPG
AIM
ESP

	x	y	z
x	5.447	0.020	0.000
y	0.020	4.656	0.000
z	0.000	0.000	4.266

<r²>	52.423
(<r²>)^1/2	7.240

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

using model chemistry: BLYP/6-31+G**

States and conformations

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