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	hartrees
Energy at 0K	-39.524521
Energy at 298.15K	-39.530743
HF Energy	-39.153071
Nuclear repulsion energy	66.293222

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3644	3521	33.76
2	A'	3472	3355	6.74
3	A'	3172	3065	31.32
4	A'	3057	2954	17.32
5	A'	1640	1584	125.76
6	A'	1515	1464	37.28
7	A'	1463	1414	28.92
8	A'	1394	1347	16.15
9	A'	1225	1183	80.59
10	A'	1081	1044	109.43
11	A'	1010	976	164.56
12	A'	834	806	5.82
13	A'	510	493	47.89
14	A'	397	384	3.81
15	A"	3163	3057	21.09
16	A"	1499	1448	10.76
17	A"	1104	1066	6.18
18	A"	851	822	45.47
19	A"	607	586	219.86
20	A"	494	477	7.89
21	A"	121	117	1.38

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.134	0.000
C2	1.120	-0.923	0.000
N3	0.042	1.457	0.000
O4	-1.275	-0.492	0.000
H5	2.114	-0.432	0.000
H6	1.024	-1.567	0.897
H7	1.024	-1.567	-0.897
H8	1.007	1.833	0.000
H9	-1.977	0.209	0.000

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.5401	1.3239	1.4205	2.1879	2.1782	2.1782	1.9756	1.9784
C2	1.5401		2.6132	2.4342	1.1084	1.1085	1.1085	2.7588	3.2978
N3	1.3239	2.6132		2.3519	2.8035	3.3034	3.3034	1.0364	2.3730
O4	1.4205	2.4342	2.3519		3.3895	2.6919	2.6919	3.2582	0.9918
H5	2.1879	1.1084	2.8035	3.3895		1.8117	1.8117	2.5206	4.1405
H6	2.1782	1.1085	3.3034	2.6919	1.8117		1.7946	3.5165	3.6005
H7	2.1782	1.1085	3.3034	2.6919	1.8117	1.7946		3.5165	3.6005
H8	1.9756	2.7588	1.0364	3.2582	2.5206	3.5165	3.5165		3.3975
H9	1.9784	3.2978	2.3730	0.9918	4.1405	3.6005	3.6005	3.3975

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.334	C1	C2	H6	109.575
C1	C2	H7	109.575	C1	N3	H8	113.090
C1	O4	H9	108.906	C2	C1	N3	131.535
C2	C1	O4	110.546	N3	C1	O4	117.919
H5	C2	H6	109.615	H5	C2	H7	109.615
H6	C2	H7	108.091

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

using model chemistry: MP2/CEP-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 CH3C(OH)=NH (Ethaninidic acid)

using model chemistry: MP2/CEP-31G

States and conformations

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