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	hartrees
Energy at 0K	-30.206016
Energy at 298.15K
HF Energy	-30.206016
Nuclear repulsion energy	43.271844

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3766	3637	5.05
2	A'	3147	3039	15.44
3	A'	3006	2903	90.32
4	A'	1515	1463	0.18
5	A'	1474	1423	5.75
6	A'	1417	1369	5.87
7	A'	1230	1187	62.30
8	A'	1043	1007	65.20
9	A'	967	934	60.65
10	A'	630	608	40.62
11	A'	371	358	39.05
12	A"	3250	3138	30.86
13	A"	3044	2940	76.19
14	A"	1272	1228	0.05
15	A"	1150	1110	1.23
16	A"	794	766	0.00
17	A"	255	247	141.60
18	A"	136i	131i	0.39

Atom	x (Å)	y (Å)	z (Å)
O1	-1.129	-0.375	0.000
C2	0.000	0.548	0.000
C3	1.279	-0.257	0.000
H4	-1.938	0.170	0.000
H5	-0.038	1.195	0.900
H6	-0.038	1.195	-0.900
H7	1.683	-0.652	-0.939
H8	1.683	-0.652	0.939

	O1	C2	C3	H4	H5	H6	H7	H8
O1		1.4577	2.4110	0.9757	2.1120	2.1120	2.9774	2.9774
C2	1.4577		1.5117	1.9742	1.1086	1.1086	2.2704	2.2704
C3	2.4110	1.5117		3.2456	2.1572	2.1572	1.0956	1.0956
H4	0.9757	1.9742	3.2456		2.3379	2.3379	3.8301	3.8301
H5	2.1120	1.1086	2.1572	2.3379		1.7992	3.1232	2.5251
H6	2.1120	1.1086	2.1572	2.3379	1.7992		2.5251	3.1232
H7	2.9774	2.2704	1.0956	3.8301	3.1232	2.5251		1.8774
H8	2.9774	2.2704	1.0956	3.8301	2.5251	3.1232	1.8774

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O1	C2	C3	108.556	O1	C2	H5	110.024
O1	C2	H6	110.024	C2	O1	H4	106.765
C2	C3	H7	120.263	C2	C3	H8	120.263
C3	C2	H5	109.874	C3	C2	H6	109.874
H5	C2	H6	108.484	H7	C3	H8	117.921

All results from a given calculation for CH₂CH₂OH (2-hydroxy ethyl radical)

using model chemistry: B3LYP/CEP-31G*

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	O	-0.467
2	C	-0.146
3	C	-0.413
4	H	0.361
5	H	0.134
6	H	0.134
7	H	0.199
8	H	0.199

	x	y	z	Total
	-0.125	1.639	0.000	1.643
CHELPG
AIM
ESP

	x	y	z
x	4.607	-0.516	0.000
y	-0.516	3.318	0.000
z	0.000	0.000	3.112

<r²>	44.516
(<r²>)^1/2	6.672

All results from a given calculation for CH2CH2OH (2-hydroxy ethyl radical)

using model chemistry: B3LYP/CEP-31G*

States and conformations

All results from a given calculation for CH₂CH₂OH (2-hydroxy ethyl radical)