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	hartrees
Energy at 0K	-153.433496
Energy at 298.15K	-153.438398
HF Energy	-153.433496
Nuclear repulsion energy	73.311392

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3291	2962	57.26
2	A'	3224	2901	23.49
3	A'	3205	2884	42.49
4	A'	1647	1482	9.68
5	A'	1616	1454	6.15
6	A'	1572	1415	14.00
7	A'	1514	1362	8.85
8	A'	1210	1089	9.80
9	A'	1131	1018	31.49
10	A'	935	842	6.74
11	A'	445	400	8.45
12	A"	3307	2976	70.41
13	A"	3266	2939	5.23
14	A"	1633	1469	5.58
15	A"	1384	1246	0.83
16	A"	969	872	0.15
17	A"	273	245	14.05
18	A"	74	66	19.58

Atom	x (Å)	y (Å)	z (Å)
C1	1.078	-0.535	0.000
C2	0.000	0.545	0.000
O3	-1.331	-0.002	0.000
H4	2.065	-0.085	0.000
H5	0.989	-1.164	0.877
H6	0.989	-1.164	-0.877
H7	0.068	1.184	0.873
H8	0.068	1.184	-0.873

	C1	C2	O3	H4	H5	H6	H7	H8
C1		1.5253	2.4669	1.0850	1.0832	1.0832	2.1763	2.1763
C2	1.5253		1.4385	2.1589	2.1603	2.1603	1.0845	1.0845
O3	2.4669	1.4385		3.3970	2.7391	2.7391	2.0312	2.0312
H4	1.0850	2.1589	3.3970		1.7585	1.7585	2.5219	2.5219
H5	1.0832	2.1603	2.7391	1.7585		1.7543	2.5222	3.0701
H6	1.0832	2.1603	2.7391	1.7585	1.7543		3.0701	2.5222
H7	2.1763	1.0845	2.0312	2.5219	2.5222	3.0701		1.7465
H8	2.1763	1.0845	2.0312	2.5219	3.0701	2.5222	1.7465

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	112.647	C1	C2	H7	111.888
C1	C2	H8	111.888	C2	C1	H4	110.454
C2	C1	H5	110.681	C2	C1	H6	110.681
O3	C2	H7	106.384	O3	C2	H8	106.384
H4	C1	H5	108.394	H4	C1	H6	108.394
H5	C1	H6	108.153	H7	C2	H8	107.259

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

using model chemistry: HF/LANL2DZ

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	-0.518
2	C	-0.126
3	O	-0.277
4	H	0.167
5	H	0.188
6	H	0.188
7	H	0.189
8	H	0.189

	x	y	z	Total
	2.362	0.904	0.000	2.529
CHELPG
AIM
ESP

	x	y	z
x	3.607	0.074	0.000
y	0.074	3.206	0.000
z	0.000	0.000	3.422

<r²>	51.932
(<r²>)^1/2	7.206

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

using model chemistry: HF/LANL2DZ

States and conformations

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