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	hartrees
Energy at 0K	-208.722692
Energy at 298.15K	-208.729206
HF Energy	-208.041675
Nuclear repulsion energy	122.915374

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3985	3692	79.51
2	A'	3704	3432	9.15
3	A'	3266	3026	11.05
4	A'	3166	2933	4.78
5	A'	1859	1722	264.71
6	A'	1557	1442	26.88
7	A'	1526	1414	76.82
8	A'	1456	1349	2.11
9	A'	1328	1230	95.57
10	A'	1170	1084	192.18
11	A'	1072	993	33.65
12	A'	920	852	0.75
13	A'	578	535	42.96
14	A'	442	410	1.72
15	A"	3239	3001	5.67
16	A"	1543	1429	7.68
17	A"	1128	1045	8.29
18	A"	902	836	29.37
19	A"	650	602	109.01
20	A"	547	507	39.20
21	A"	143	132	0.50

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.133	0.000
C2	0.887	-1.067	0.000
N3	0.317	1.346	0.000
O4	-1.293	-0.218	0.000
H5	1.927	-0.781	0.000
H6	0.678	-1.671	0.873
H7	0.678	-1.671	-0.873
H8	1.314	1.457	0.000
H9	-1.796	0.593	0.000

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.4923	1.2541	1.3398	2.1327	2.1160	2.1160	1.8656	1.8537
C2	1.4923		2.4797	2.3398	1.0789	1.0818	1.0818	2.5600	3.1547
N3	1.2541	2.4797		2.2449	2.6674	3.1619	3.1619	1.0031	2.2435
O4	1.3398	2.3398	2.2449		3.2691	2.6005	2.6005	3.0989	0.9535
H5	2.1327	1.0789	2.6674	3.2691		1.7647	1.7647	2.3199	3.9681
H6	2.1160	1.0818	3.1619	2.6005	1.7647		1.7459	3.3093	3.4654
H7	2.1160	1.0818	3.1619	2.6005	1.7647	1.7459		3.3093	3.4654
H8	1.8656	2.5600	1.0031	3.0989	2.3199	3.3093	3.3093		3.2279
H9	1.8537	3.1547	2.2435	0.9535	3.9681	3.4654	3.4654	3.2279

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	111.067	C1	C2	H6	109.542
C1	C2	H7	109.542	C1	N3	H8	110.990
C1	O4	H9	106.645	C2	C1	N3	128.875
C2	C1	O4	111.301	N3	C1	O4	119.824
H5	C2	H6	109.515	H5	C2	H7	109.515
H6	C2	H7	107.591

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

using model chemistry: CID/cc-pVTZ

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: CID/cc-pVTZ

States and conformations

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