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	hartrees
Energy at 0K	-153.440472
Energy at 298.15K
HF Energy	-153.440472
Nuclear repulsion energy	72.981690

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3111	2947	10.45
2	A'	3039	2878	6.14
3	A'	3023	2864	16.85
4	A'	1559	1476	8.79
5	A'	1495	1416	11.87
6	A'	1456	1379	13.42
7	A'	1386	1312	3.29
8	A'	1118	1059	6.62
9	A'	1040	985	15.43
10	A'	878	832	0.08
11	A'	391	371	6.11
12	A"	3122	2957	11.31
13	A"	3046	2885	1.63
14	A"	1543	1462	5.59
15	A"	1295	1227	1.37
16	A"	901	854	0.42
17	A"	193	183	8.60
18	A"	420i	398i	43.62

Atom	x (Å)	y (Å)	z (Å)
C1	1.079	-0.545	0.000
C2	0.000	0.542	0.000
O3	-1.335	0.010	0.000
H4	2.077	-0.098	0.000
H5	0.974	-1.176	0.887
H6	0.974	-1.176	-0.887
H7	0.089	1.196	0.880
H8	0.089	1.196	-0.880

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.5315	2.4766	1.0937	1.0931	1.0931	2.1878	2.1878
C2	1.5315		1.4368	2.1736	2.1641	2.1641	1.1005	1.1005
O3	2.4766	1.4368		3.4137	2.7420	2.7420	2.0519	2.0519
H4	1.0937	2.1736	3.4137		1.7791	1.7791	2.5303	2.5303
H5	1.0931	2.1641	2.7420	1.7791		1.7733	2.5314	3.0869
H6	1.0931	2.1641	2.7420	1.7791	1.7733		3.0869	2.5314
H7	2.1878	1.1005	2.0519	2.5303	2.5314	3.0869		1.7602
H8	2.1878	1.1005	2.0519	2.5303	3.0869	2.5314	1.7602

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	113.059	C1	C2	H7	111.403
C1	C2	H8	111.403	C2	C1	H4	110.684
C2	C1	H5	109.959	C2	C1	H6	109.959
O3	C2	H7	107.199	O3	C2	H8	107.199
H4	C1	H5	108.889	H4	C1	H6	108.889
H5	C1	H6	108.412	H7	C2	H8	106.209

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

using model chemistry: M06-2X/3-21G*

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	-0.600
2	C	-0.187
3	O	-0.293
4	H	0.193
5	H	0.214
6	H	0.214
7	H	0.230
8	H	0.230

	x	y	z	Total
	1.881	0.772	0.000	2.034
CHELPG
AIM
ESP

	x	y	z
x	3.653	0.066	0.000
y	0.066	3.225	0.000
z	0.000	0.000	3.405

<r²>	51.931
(<r²>)^1/2	7.206

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

using model chemistry: M06-2X/3-21G*

States and conformations

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