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	hartrees
Energy at 0K	-168.643901
Energy at 298.15K	-168.650345
HF Energy	-168.643901
Nuclear repulsion energy	79.913342

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3774	3333	37.00
2	A	3737	3300	9.24
3	A	3550	3135	13.80
4	A	3447	3044	1.53
5	A	3314	2927	14.34
6	A	1880	1660	4.57
7	A	1640	1449	0.35
8	A	1599	1412	13.66
9	A	1506	1330	1.22
10	A	1484	1311	21.73
11	A	1248	1102	0.49
12	A	1207	1066	4.98
13	A	1126	994	72.45
14	A	948	837	14.99
15	A	933	824	74.23
16	A	453	400	40.37
17	A	403	356	83.46
18	A	325	287	36.04

Atom	x (Å)	y (Å)	z (Å)
N1	1.280	-0.156	-0.014
C2	-0.044	0.556	0.054
O3	-1.227	-0.274	-0.129
H4	1.236	-0.725	-0.904
H5	1.238	-0.902	0.734
H6	-0.064	1.110	1.020
H7	-0.065	1.293	-0.773
H8	-1.230	-0.828	0.730

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.5049	2.5124	1.0565	1.0575	2.1164	2.1176	2.7036
C2	1.5049		1.4572	2.0483	2.0566	1.1129	1.1081	1.9445
O3	2.5124	1.4572		2.6205	2.6854	2.1413	2.0545	1.0219
H4	1.0565	2.0483	2.6205		1.6472	2.9588	2.4041	2.9600
H5	1.0575	2.0566	2.6854	1.6472		2.4129	2.9640	2.4692
H6	2.1164	1.1129	2.1413	2.9588	2.4129		1.8024	2.2796
H7	2.1176	1.1081	2.0545	2.4041	2.9640	1.8024		2.8488
H8	2.7036	1.9445	1.0219	2.9600	2.4692	2.2796	2.8488

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	116.019	N1	C2	H6	106.943
N1	C2	H7	107.303	C2	N1	H4	104.846
C2	N1	H5	105.428	C2	O3	H8	101.887
O3	C2	H6	112.160	O3	C2	H7	105.627
H4	N1	H5	102.374	H6	C2	H7	108.493

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: HSEh1PBE/STO-3G

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	N	-0.374
2	C	-0.006
3	O	-0.253
4	H	0.159
5	H	0.147
6	H	0.074
7	H	0.089
8	H	0.165

	x	y	z	Total
	-0.389	-1.165	0.958	1.558
CHELPG
AIM
ESP

	x	y	z
x	1.800	-0.033	-0.122
y	-0.033	1.821	-0.271
z	-0.122	-0.271	1.964

<r²>	50.515
(<r²>)^1/2	7.107

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: HSEh1PBE/STO-3G

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)