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	hartrees
Energy at 0K
Energy at 298.15K	-0.063423
HF Energy	-0.063423
Nuclear repulsion energy	86.513500

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	2819	2994	137.69
2	A'	2786	2960	63.61
3	A'	2694	2863	93.10
4	A'	2554	2713	281.09
5	A'	1792	1904	371.46
6	A'	1395	1482	207.85
7	A'	1322	1405	123.70
8	A'	1220	1296	134.29
9	A'	1213	1289	35.01
10	A'	1064	1130	249.83
11	A'	1005	1067	3.90
12	A'	970	1031	3.15
13	A'	480	510	31.83
14	A'	379	403	0.71
15	A"	2680	2847	135.18
16	A"	1222	1298	63.96
17	A"	1025	1089	95.83
18	A"	768	815	111.12
19	A"	545	579	115.41
20	A"	484	514	41.40
21	A"	57i	60i	0.50

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.136	0.000
C2	1.180	-0.775	0.000
N3	-0.144	1.416	0.000
O4	-1.153	-0.620	0.000
H5	2.133	-0.232	0.000
H6	1.167	-1.438	0.881
H7	1.167	-1.438	-0.881
H8	0.657	2.035	0.000
H9	-1.972	-0.043	0.000

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.4908	1.2878	1.3786	2.1642	2.1483	2.1483	2.0096	1.9801
C2	1.4908		2.5597	2.3382	1.0966	1.1026	1.1026	2.8587	3.2359
N3	1.2878	2.5597		2.2720	2.8102	3.2616	3.2616	1.0120	2.3389
O4	1.3786	2.3382	2.2720		3.3085	2.6130	2.6130	3.2130	1.0018
H5	2.1642	1.0966	2.8102	3.3085		1.7786	1.7786	2.7054	4.1091
H6	2.1483	1.1026	3.2616	2.6130	1.7786		1.7619	3.6195	3.5462
H7	2.1483	1.1026	3.2616	2.6130	1.7786	1.7619		3.6195	3.5462
H8	2.0096	2.8587	1.0120	3.2130	2.7054	3.6195	3.6195		3.3509
H9	1.9801	3.2359	2.3389	1.0018	4.1091	3.5462	3.5462	3.3509

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	112.641	C1	C2	H6	110.983
C1	C2	H7	110.983	C1	N3	H8	121.336
C1	O4	H9	111.603	C2	C1	N3	134.079
C2	C1	O4	109.087	N3	C1	O4	116.834
H5	C2	H6	107.944	H5	C2	H7	107.944
H6	C2	H7	106.060

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

using model chemistry: PM6

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: PM6

States and conformations

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