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	hartrees
Energy at 0K	-208.646230
Energy at 298.15K	-208.652624
HF Energy	-207.975285
Nuclear repulsion energy	121.710561

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3899	3632	59.11
2	A'	3643	3394	5.68
3	A'	3253	3031	11.70
4	A'	3148	2933	6.34
5	A'	1814	1690	235.30
6	A'	1544	1439	17.44
7	A'	1497	1394	67.63
8	A'	1440	1341	7.34
9	A'	1300	1211	82.39
10	A'	1151	1072	184.80
11	A'	1056	984	45.73
12	A'	901	840	1.09
13	A'	560	522	44.40
14	A'	434	405	2.09
15	A"	3232	3011	5.29
16	A"	1526	1422	8.00
17	A"	1098	1023	3.72
18	A"	876	816	34.58
19	A"	603	562	127.83
20	A"	520	485	39.61
21	A"	133	124	0.70

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.132	0.000
C2	0.932	-1.044	0.000
N3	0.269	1.374	0.000
O4	-1.296	-0.271	0.000
H5	1.966	-0.715	0.000
H6	0.745	-1.656	0.879
H7	0.745	-1.656	-0.879
H8	1.270	1.524	0.000
H9	-1.836	0.528	0.000

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.5006	1.2709	1.3569	2.1409	2.1271	2.1271	1.8848	1.8779
C2	1.5006		2.5075	2.3578	1.0851	1.0873	1.0873	2.5905	3.1831
N3	1.2709	2.5075		2.2703	2.6920	3.1908	3.1908	1.0129	2.2680
O4	1.3569	2.3578	2.2703		3.2917	2.6180	2.6180	3.1318	0.9649
H5	2.1409	1.0851	2.6920	3.2917		1.7745	1.7745	2.3451	3.9999
H6	2.1271	1.0873	3.1908	2.6180	1.7745		1.7582	3.3410	3.4933
H7	2.1271	1.0873	3.1908	2.6180	1.7745	1.7582		3.3410	3.4933
H8	1.8848	2.5905	1.0129	3.1318	2.3451	3.3410	3.3410		3.2618
H9	1.8779	3.1831	2.2680	0.9649	3.9999	3.4933	3.4933	3.2618

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.761	C1	C2	H6	109.523
C1	C2	H7	109.523	C1	N3	H8	110.729
C1	O4	H9	106.744	C2	C1	N3	129.395
C2	C1	O4	111.106	N3	C1	O4	119.498
H5	C2	H6	109.540	H5	C2	H7	109.540
H6	C2	H7	107.903

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

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

States and conformations

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