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	hartrees
Energy at 0K	-208.629586
Energy at 298.15K	-208.635970
HF Energy	-207.975102
Nuclear repulsion energy	121.596430

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3897	3626	58.88
2	A'	3639	3386	5.52
3	A'	3249	3024	11.90
4	A'	3145	2927	6.46
5	A'	1811	1685	234.07
6	A'	1542	1435	17.26
7	A'	1495	1391	67.31
8	A'	1438	1338	6.92
9	A'	1300	1209	81.92
10	A'	1150	1070	184.58
11	A'	1055	982	46.06
12	A'	900	838	1.08
13	A'	559	520	44.31
14	A'	433	403	2.08
15	A"	3228	3004	5.43
16	A"	1523	1417	7.87
17	A"	1096	1020	3.54
18	A"	874	813	34.60
19	A"	600	558	128.30
20	A"	518	482	38.78
21	A"	131	122	0.71

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.132	0.000
C2	0.934	-1.045	0.000
N3	0.268	1.376	0.000
O4	-1.297	-0.272	0.000
H5	1.968	-0.714	0.000
H6	0.747	-1.657	0.880
H7	0.747	-1.657	-0.880
H8	1.270	1.526	0.000
H9	-1.837	0.528	0.000

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.5022	1.2720	1.3582	2.1427	2.1293	2.1293	1.8856	1.8790
C2	1.5022		2.5102	2.3603	1.0862	1.0884	1.0884	2.5921	3.1858
N3	1.2720	2.5102		2.2722	2.6944	3.1941	3.1941	1.0138	2.2690
O4	1.3582	2.3603	2.2722		3.2949	2.6209	2.6209	3.1340	0.9654
H5	2.1427	1.0862	2.6944	3.2949		1.7764	1.7764	2.3460	4.0029
H6	2.1293	1.0884	3.1941	2.6209	1.7764		1.7602	3.3434	3.4965
H7	2.1293	1.0884	3.1941	2.6209	1.7764	1.7602		3.3434	3.4965
H8	1.8856	2.5921	1.0138	3.1340	2.3460	3.3434	3.3434		3.2635
H9	1.8790	3.1858	2.2690	0.9654	4.0029	3.4965	3.4965	3.2635

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.725	C1	C2	H6	109.525
C1	C2	H7	109.525	C1	N3	H8	110.653
C1	O4	H9	106.707	C2	C1	N3	129.415
C2	C1	O4	111.113	N3	C1	O4	119.471
H5	C2	H6	109.550	H5	C2	H7	109.550
H6	C2	H7	107.917

All results from a given calculation for CH₃C(OH)=NH (Ethaninidic acid)

using model chemistry: MP3/6-31+G**

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 CH3C(OH)=NH (Ethaninidic acid)

using model chemistry: MP3/6-31+G**

States and conformations

All results from a given calculation for CH₃C(OH)=NH (Ethaninidic acid)