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	hartrees
Energy at 0K	-153.378493
Energy at 298.15K	-153.382634
Nuclear repulsion energy	70.184900

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3914	3670	25.87
2	A'	3348	3139	11.10
3	A'	3288	3083	7.52
4	A'	3241	3039	5.80
5	A'	1778	1667	113.94
6	A'	1504	1410	19.87
7	A'	1396	1308	0.24
8	A'	1365	1279	4.20
9	A'	1153	1081	183.46
10	A'	986	924	12.00
11	A'	497	466	14.11
12	A"	1010	947	28.80
13	A"	833	781	51.88
14	A"	720	675	0.46
15	A"	438	410	130.35

Atom	x (Å)	y (Å)
C1	1.215	-0.104
C2	0.000	0.445
O3	-1.196	-0.219
H4	1.365	-1.175
H5	2.091	0.525
H6	-0.158	1.515
H7	-1.021	-1.166

	C1	C2	O3	H4	H5	H6	H7
C1		1.3334	2.4138	1.0819	1.0779	2.1227	2.4756
C2	1.3334		1.3678	2.1187	2.0923	1.0812	1.9071
O3	2.4138	1.3678		2.7337	3.3698	2.0203	0.9629
H4	1.0819	2.1187	2.7337		1.8486	3.0913	2.3860
H5	1.0779	2.0923	3.3698	1.8486		2.4573	3.5414
H6	2.1227	1.0812	2.0203	3.0913	2.4573		2.8158
H7	2.4756	1.9071	0.9629	2.3860	3.5414	2.8158

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	126.655	C1	C2	H6	122.727
C2	C1	H4	122.265	C2	C1	H5	120.019
C2	O3	H7	108.573	O3	C2	H6	110.618
H4	C1	H5	117.716

All results from a given calculation for CH₂CHOH (ethenol)

using model chemistry: CCD/6-31G**

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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All results from a given calculation for CH2CHOH (ethenol)

using model chemistry: CCD/6-31G**

States and conformations

All results from a given calculation for CH₂CHOH (ethenol)