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	hartrees
Energy at 0K	-153.495208
Energy at 298.15K	-153.500398
HF Energy	-153.495208
Nuclear repulsion energy	74.360896

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3244	2775	52.33
2	A'	3184	2725	15.44
3	A'	3164	2707	44.19
4	A'	1631	1395	5.13
5	A'	1586	1357	9.26
6	A'	1558	1333	18.58
7	A'	1520	1301	6.40
8	A'	1203	1029	8.47
9	A'	1158	991	36.77
10	A'	960	822	2.79
11	A'	457	391	6.79
12	A"	3256	2786	62.85
13	A"	3192	2731	19.27
14	A"	1617	1383	3.27
15	A"	1378	1179	0.52
16	A"	943	807	0.16
17	A"	315	269	16.14
18	A"	206	176	3.84

Atom	x (Å)	y (Å)	z (Å)
C1	1.046	-0.572	0.000
C2	0.000	0.530	0.000
O3	-1.300	0.057	0.000
H4	2.048	-0.154	0.000
H5	0.939	-1.200	0.877
H6	0.939	-1.200	-0.877
H7	0.099	1.176	0.871
H8	0.099	1.176	-0.871

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.5187	2.4278	1.0858	1.0843	1.0843	2.1696	2.1696
C2	1.5187		1.3830	2.1592	2.1546	2.1546	1.0884	1.0884
O3	2.4278	1.3830		3.3541	2.7127	2.7127	1.9912	1.9912
H4	1.0858	2.1592	3.3541		1.7586	1.7586	2.5151	2.5151
H5	1.0843	2.1546	2.7127	1.7586		1.7550	2.5194	3.0664
H6	1.0843	2.1546	2.7127	1.7586	1.7550		3.0664	2.5194
H7	2.1696	1.0884	1.9912	2.5151	2.5194	3.0664		1.7411
H8	2.1696	1.0884	1.9912	2.5151	3.0664	2.5194	1.7411

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	113.502	C1	C2	H7	111.586
C1	C2	H8	111.586	C2	C1	H4	110.903
C2	C1	H5	110.627	C2	C1	H6	110.627
O3	C2	H7	106.748	O3	C2	H8	106.748
H4	C1	H5	108.269	H4	C1	H6	108.269
H5	C1	H6	108.048	H7	C2	H8	106.234

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

using model chemistry: ROHF/6-311G*

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	-0.622
2	C	-0.176
3	O	-0.262
4	H	0.202
5	H	0.214
6	H	0.214
7	H	0.215
8	H	0.215

	x	y	z	Total
	1.837	0.674	0.000	1.957
CHELPG
AIM
ESP

<r²>	50.795
(<r²>)^1/2	7.127

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

using model chemistry: ROHF/6-311G*

States and conformations

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