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	hartrees
Energy at 0K	-209.010171
Energy at 298.15K
HF Energy	-209.010171
Nuclear repulsion energy	121.765265

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3742	3712	44.64
2	A	3595	3565	21.22
3	A	3484	3455	14.99
4	A	3188	3161	7.90
5	A	3101	3076	0.90
6	A	1673	1659	346.17
7	A	1580	1567	57.88
8	A	1405	1394	5.33
9	A	1374	1363	56.96
10	A	1183	1174	107.72
11	A	1080	1071	67.45
12	A	945	938	2.88
13	A	914	906	29.80
14	A	680	674	110.54
15	A	650	644	1.00
16	A	635	630	34.94
17	A	551	546	233.27
18	A	498	494	14.07
19	A	447	443	21.50
20	A	403	399	51.24
21	A	202	201	33.64

Atom	x (Å)	y (Å)	z (Å)
C1	0.057	-0.044	-0.004
C2	1.191	-0.774	0.017
N3	-1.238	-0.534	-0.088
O4	0.022	1.328	-0.009
H5	2.166	-0.294	-0.033
H6	1.157	-1.859	0.045
H7	-1.331	-1.518	0.141
H8	-1.929	0.046	0.382
H9	0.935	1.647	0.070

	C1	C2	N3	O4	H5	H6	H7	H8	H9
C1		1.3486	1.3875	1.3717	2.1242	2.1236	2.0300	2.0256	1.9063
C2	1.3486		2.4431	2.4046	1.0878	1.0867	2.6321	3.2466	2.4348
N3	1.3875	2.4431		2.2493	3.4133	2.7408	1.0145	1.0171	3.0826
O4	1.3717	2.4046	2.2493		2.6889	3.3836	3.1543	2.3671	0.9701
H5	2.1242	1.0878	3.4133	2.6889		1.8637	3.7089	4.1305	2.3016
H6	2.1236	1.0867	2.7408	3.3836	1.8637		2.5130	3.6427	3.5137
H7	2.0300	2.6321	1.0145	3.1543	3.7089	2.5130		1.6918	3.8929
H8	2.0256	3.2466	1.0171	2.3671	4.1305	3.6427	1.6918		3.2959
H9	1.9063	2.4348	3.0826	0.9701	2.3016	3.5137	3.8929	3.2959

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	H5	120.979	C1	C2	H6	121.006
C1	N3	H7	114.485	C1	N3	H8	113.901
C1	O4	H9	107.749	C2	C1	N3	126.477
C2	C1	O4	124.241	N3	C1	O4	109.217
H5	C2	H6	117.972	H7	N3	H8	112.768

All results from a given calculation for CH₂C(OH)NH₂ (1-amino vinyl alchohol)

using model chemistry: PBEPBE/6-311+G(3df,2p)

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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Number	Element	Mulliken
1	C	0.873
2	C	-0.321
3	N	-0.776
4	O	-0.617
5	H	0.100
6	H	0.108
7	H	0.190
8	H	0.191
9	H	0.251

	x	y	z	Total
	-0.240	-0.166	1.011	1.052
CHELPG
AIM
ESP

	x	y	z
x	8.108	-0.617	0.077
y	-0.617	6.619	0.014
z	0.077	0.014	4.978

<r²>	75.149
(<r²>)^1/2	8.669

All results from a given calculation for CH2C(OH)NH2 (1-amino vinyl alchohol)

using model chemistry: PBEPBE/6-311+G(3df,2p)

States and conformations

All results from a given calculation for CH₂C(OH)NH₂ (1-amino vinyl alchohol)