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	hartrees
Energy at 0K	-153.119949
Energy at 298.15K	-153.124089
Nuclear repulsion energy	69.248099

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3748	3515	16.69
2	A'	3309	3104	18.00
3	A'	3283	3078	1.35
4	A'	3207	3007	5.78
5	A'	1747	1638	90.87
6	A'	1518	1424	14.21
7	A'	1402	1315	0.21
8	A'	1371	1285	6.99
9	A'	1125	1055	171.12
10	A'	971	911	39.97
11	A'	493	462	15.09
12	A"	1021	958	37.11
13	A"	903	846	82.63
14	A"	712	668	0.30
15	A"	428	401	192.27

Atom	x (Å)	y (Å)
C1	1.233	-0.069
C2	0.000	0.456
O3	-1.205	-0.257
H4	1.416	-1.141
H5	2.103	0.577
H6	-0.205	1.519
H7	-1.067	-1.219

	C1	C2	O3	H4	H5	H6	H7
C1		1.3397	2.4455	1.0877	1.0835	2.1422	2.5715
C2	1.3397		1.4006	2.1343	2.1066	1.0829	1.9860
O3	2.4455	1.4006		2.7668	3.4121	2.0385	0.9719
H4	1.0877	2.1343	2.7668		1.8496	3.1152	2.4847
H5	1.0835	2.1066	3.4121	1.8496		2.4934	3.6435
H6	2.1422	1.0829	2.0385	3.1152	2.4934		2.8706
H7	2.5715	1.9860	0.9719	2.4847	3.6435	2.8706

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	126.348	C1	C2	H6	123.978
C2	C1	H4	122.769	C2	C1	H5	120.398
C2	O3	H7	112.411	O3	C2	H6	109.674
H4	C1	H5	116.834

All results from a given calculation for CH₂CHOH (ethenol)

using model chemistry: CISD/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: CISD/6-31G

States and conformations

All results from a given calculation for CH₂CHOH (ethenol)