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	hartrees
Energy at 0K	-208.567950
Energy at 298.15K	-208.574357
HF Energy	-207.951317
Nuclear repulsion energy	121.507954

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3769	3537	52.17
2	A'	3559	3340	1.20
3	A'	3217	3020	11.06
4	A'	3120	2928	4.07
5	A'	1832	1720	200.43
6	A'	1550	1454	22.47
7	A'	1510	1417	73.20
8	A'	1447	1358	1.02
9	A'	1323	1242	101.36
10	A'	1158	1087	187.92
11	A'	1055	990	33.89
12	A'	904	848	0.70
13	A'	563	528	43.04
14	A'	433	406	2.39
15	A"	3197	3001	5.24
16	A"	1531	1437	8.07
17	A"	1106	1039	9.64
18	A"	889	834	30.46
19	A"	633	594	153.55
20	A"	525	493	22.75
21	A"	135	127	0.83

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.133	0.000
C2	0.941	-1.038	0.000
N3	0.253	1.378	0.000
O4	-1.293	-0.284	0.000
H5	1.980	-0.704	0.000
H6	0.757	-1.657	0.883
H7	0.757	-1.657	-0.883
H8	1.259	1.543	0.000
H9	-1.831	0.528	0.000

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.5027	1.2708	1.3582	2.1496	2.1344	2.1344	1.8901	1.8734
C2	1.5027		2.5127	2.3582	1.0913	1.0935	1.0935	2.6007	3.1844
N3	1.2708	2.5127		2.2696	2.7049	3.2007	3.2007	1.0191	2.2513
O4	1.3582	2.3582	2.2696		3.2997	2.6206	2.6206	3.1379	0.9737
H5	2.1496	1.0913	2.7049	3.2997		1.7841	1.7841	2.3594	4.0054
H6	2.1344	1.0935	3.2007	2.6206	1.7841		1.7657	3.3568	3.5003
H7	2.1344	1.0935	3.2007	2.6206	1.7841	1.7657		3.3568	3.5003
H8	1.8901	2.6007	1.0191	3.1379	2.3594	3.3568	3.3568		3.2526
H9	1.8734	3.1844	2.2513	0.9737	4.0054	3.5003	3.5003	3.2526

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.926	C1	C2	H6	109.593
C1	C2	H7	109.593	C1	N3	H8	110.786
C1	O4	H9	105.720	C2	C1	N3	129.722
C2	C1	O4	110.931	N3	C1	O4	119.347
H5	C2	H6	109.490	H5	C2	H7	109.490
H6	C2	H7	107.687

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

using model chemistry: MP3/6-31G*

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 CH3C(OH)=NH (Ethaninidic acid)

using model chemistry: MP3/6-31G*

States and conformations

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