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	hartrees
Energy at 0K	-152.364454
Energy at 298.15K	-152.368594
Nuclear repulsion energy	68.913508

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3492	3384	3.95
2	A'	3232	3133	11.47
3	A'	3191	3092	4.11
4	A'	3138	3041	4.87
5	A'	1688	1636	67.68
6	A'	1510	1464	14.71
7	A'	1399	1356	5.40
8	A'	1367	1325	8.75
9	A'	1099	1065	117.18
10	A'	946	917	46.67
11	A'	487	472	14.06
12	A"	1006	975	31.23
13	A"	872	846	79.42
14	A"	697	676	0.13
15	A"	456	442	155.88

Atom	x (Å)	y (Å)
C1	1.239	-0.063
C2	0.000	0.450
O3	-1.218	-0.258
H4	1.432	-1.136
H5	2.105	0.592
H6	-0.197	1.519
H7	-1.030	-1.233

	C1	C2	O3	H4	H5	H6	H7
C1		1.3412	2.4651	1.0901	1.0860	2.1365	2.5530
C2	1.3412		1.4088	2.1370	2.1098	1.0869	1.9734
O3	2.4651	1.4088		2.7921	3.4302	2.0493	0.9938
H4	1.0901	2.1370	2.7921		1.8549	3.1148	2.4639
H5	1.0860	2.1098	3.4302	1.8549		2.4811	3.6278
H6	2.1365	1.0869	2.0493	3.1148	2.4811		2.8757
H7	2.5530	1.9734	0.9938	2.4639	3.6278	2.8757

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	127.357	C1	C2	H6	122.918
C2	C1	H4	122.687	C2	C1	H5	120.371
C2	O3	H7	109.223	O3	C2	H6	109.725
H4	C1	H5	116.942

All results from a given calculation for CH₂CHOH (ethenol)

using model chemistry: QCISD/3-21G

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/3-21G

States and conformations

All results from a given calculation for CH₂CHOH (ethenol)