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	hartrees
Energy at 0K	-208.825190
Energy at 298.15K	-208.831549
HF Energy	-208.048653
Nuclear repulsion energy	121.893669

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3772	3589	65.89
2	A'	3565	3392	8.17
3	A'	3207	3052	6.93
4	A'	3097	2946	4.18
5	A'	1738	1654	186.60
6	A'	1499	1426	21.65
7	A'	1454	1383	68.55
8	A'	1394	1326	1.34
9	A'	1258	1197	87.70
10	A'	1111	1057	179.55
11	A'	1021	972	38.56
12	A'	885	842	0.92
13	A'	550	523	41.48
14	A'	424	403	1.66
15	A"	3180	3026	2.70
16	A"	1489	1417	8.67
17	A"	1072	1020	4.50
18	A"	855	814	24.80
19	A"	625	594	117.64
20	A"	525	499	20.30
21	A"	129	123	0.60

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.130	0.000
C2	0.926	-1.044	0.000
N3	0.271	1.373	0.000
O4	-1.294	-0.268	0.000
H5	1.961	-0.720	0.000
H6	0.737	-1.658	0.878
H7	0.737	-1.658	-0.878
H8	1.276	1.509	0.000
H9	-1.813	0.548	0.000

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.4953	1.2719	1.3539	2.1374	2.1240	2.1240	1.8790	1.8608
C2	1.4953		2.5039	2.3515	1.0851	1.0879	1.0879	2.5773	3.1682
N3	1.2719	2.5039		2.2679	2.6895	3.1896	3.1896	1.0141	2.2417
O4	1.3539	2.3515	2.2679		3.2863	2.6128	2.6128	3.1250	0.9676
H5	2.1374	1.0851	2.6895	3.2863		1.7751	1.7751	2.3317	3.9816
H6	2.1240	1.0879	3.1896	2.6128	1.7751		1.7560	3.3307	3.4844
H7	2.1240	1.0879	3.1896	2.6128	1.7751	1.7560		3.3307	3.4844
H8	1.8790	2.5773	1.0141	3.1250	2.3317	3.3307	3.3307		3.2355
H9	1.8608	3.1682	2.2417	0.9676	3.9816	3.4844	3.4844	3.2355

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	110.846	C1	C2	H6	109.609
C1	C2	H7	109.609	C1	N3	H8	110.053
C1	O4	H9	105.339	C2	C1	N3	129.429
C2	C1	O4	111.139	N3	C1	O4	119.431
H5	C2	H6	109.547	H5	C2	H7	109.547
H6	C2	H7	107.622

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

using model chemistry: MP2/Def2TZVPP

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/Def2TZVPP

States and conformations

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