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	hartrees
Energy at 0K	-153.394950
Energy at 298.15K	-153.399090
Nuclear repulsion energy	69.794651

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3832	3676	31.64
2	A'	3288	3154	9.04
3	A'	3229	3098	6.80
4	A'	3177	3048	5.51
5	A'	1736	1666	140.42
6	A'	1456	1397	17.74
7	A'	1381	1325	1.04
8	A'	1332	1278	5.26
9	A'	1142	1096	169.34
10	A'	968	928	9.19
11	A'	485	465	13.54
12	A"	997	956	29.87
13	A"	811	778	52.66
14	A"	712	683	0.06
15	A"	460	441	105.96

Atom	x (Å)	y (Å)
C1	1.222	-0.123
C2	0.000	0.443
O3	-1.205	-0.200
H4	1.358	-1.212
H5	2.114	0.508
H6	-0.140	1.531
H7	-1.024	-1.150

	C1	C2	O3	H4	H5	H6	H7
C1		1.3468	2.4278	1.0974	1.0931	2.1421	2.4692
C2	1.3468		1.3657	2.1414	2.1148	1.0961	1.8942
O3	2.4278	1.3657		2.7557	3.3933	2.0318	0.9679
H4	1.0974	2.1414	2.7557		1.8793	3.1251	2.3826
H5	1.0931	2.1148	3.3933	1.8793		2.4744	3.5490
H6	2.1421	1.0961	2.0318	3.1251	2.4744		2.8229
H7	2.4692	1.8942	0.9679	2.3826	3.5490	2.8229

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	127.030	C1	C2	H6	122.203
C2	C1	H4	122.020	C2	C1	H5	119.810
C2	O3	H7	107.299	O3	C2	H6	110.767
H4	C1	H5	118.171

All results from a given calculation for CH₂CHOH (ethenol)

using model chemistry: QCISD/cc-pVDZ

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: QCISD/cc-pVDZ

States and conformations

All results from a given calculation for CH₂CHOH (ethenol)