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	hartrees
Energy at 0K	-171.115923
Energy at 298.15K	-171.122547
HF Energy	-171.115923
Nuclear repulsion energy	81.908988

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3733	3595	2.41
2	A	3554	3423	0.85
3	A	3472	3345	2.57
4	A	3127	3012	36.61
5	A	3032	2920	75.42
6	A	1726	1663	30.70
7	A	1523	1467	0.05
8	A	1441	1388	43.59
9	A	1408	1356	2.56
10	A	1387	1336	1.55
11	A	1169	1126	23.83
12	A	1098	1057	26.98
13	A	991	954	276.82
14	A	913	880	3.35
15	A	851	820	153.69
16	A	470	452	53.40
17	A	433	417	123.66
18	A	321	309	69.36

Atom	x (Å)	y (Å)	z (Å)
N1	1.234	-0.159	-0.022
C2	-0.029	0.537	0.047
O3	-1.208	-0.263	-0.115
H4	1.273	-0.723	-0.867
H5	1.354	-0.786	0.769
H6	-0.060	1.083	0.997
H7	-0.078	1.252	-0.773
H8	-1.289	-0.834	0.661

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4431	2.4454	1.0165	1.0167	2.0626	2.0681	2.6995
C2	1.4431		1.4340	2.0294	2.0457	1.0960	1.0896	1.9612
O3	2.4454	1.4340		2.6332	2.7604	2.0894	2.0013	0.9670
H4	1.0165	2.0294	2.6332		1.6390	2.9178	2.3954	2.9855
H5	1.0167	2.0457	2.7604	1.6390		2.3552	2.9303	2.6462
H6	2.0626	1.0960	2.0894	2.9178	2.3552		1.7783	2.3024
H7	2.0681	1.0896	2.0013	2.3954	2.9303	1.7783		2.8068
H8	2.6995	1.9612	0.9670	2.9855	2.6462	2.3024	2.8068

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	116.410	N1	C2	H6	107.867
N1	C2	H7	108.685	C2	N1	H4	109.980
C2	N1	H5	111.354	C2	O3	H8	107.951
O3	C2	H6	110.634	O3	C2	H7	104.107
H4	N1	H5	107.435	H6	C2	H7	108.902

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: TPSSh/6-311G*

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	-0.725
2	C	-0.084
3	O	-0.558
4	H	0.311
5	H	0.297
6	H	0.192
7	H	0.213
8	H	0.355

	x	y	z	Total
	0.307	-1.215	1.372	1.858
CHELPG
AIM
ESP

	x	y	z
x	3.787	-0.066	-0.103
y	-0.066	3.485	-0.174
z	-0.103	-0.174	3.488

<r²>	49.961
(<r²>)^1/2	7.068

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: TPSSh/6-311G*

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)