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	hartrees
Energy at 0K	-153.150120
Energy at 298.15K	-153.154192
Nuclear repulsion energy	68.826640

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3659	3511	10.30
2	A'	3244	3113	18.77
3	A'	3217	3086	1.90
4	A'	3144	3016	5.76
5	A'	1708	1639	63.30
6	A'	1489	1429	13.54
7	A'	1379	1323	1.94
8	A'	1348	1294	7.38
9	A'	1100	1055	149.28
10	A'	945	907	40.85
11	A'	482	462	14.15
12	A"	979	939	40.66
13	A"	867	832	65.50
14	A"	687	659	0.05
15	A"	407	390	185.39

Atom	x (Å)	y (Å)
C1	1.240	-0.068
C2	0.000	0.459
O3	-1.214	-0.260
H4	1.425	-1.146
H5	2.115	0.580
H6	-0.209	1.528
H7	-1.061	-1.227

	C1	C2	O3	H4	H5	H6	H7
C1		1.3473	2.4608	1.0934	1.0894	2.1554	2.5761
C2	1.3473		1.4109	2.1467	2.1186	1.0887	1.9923
O3	2.4608	1.4109		2.7835	3.4332	2.0511	0.9782
H4	1.0934	2.1467	2.7835		1.8586	3.1336	2.4879
H5	1.0894	2.1186	3.4332	1.8586		2.5099	3.6543
H6	2.1554	1.0887	2.0511	3.1336	2.5099		2.8834
H7	2.5761	1.9923	0.9782	2.4879	3.6543	2.8834

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	O3	126.270	C1	C2	H6	124.117
C2	C1	H4	122.831	C2	C1	H5	120.426
C2	O3	H7	111.717	O3	C2	H6	109.613
H4	C1	H5	116.743

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)