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	hartrees
Energy at 0K	-171.082226
Energy at 298.15K	-171.088810
HF Energy	-171.082226
Nuclear repulsion energy	81.859900

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3772	3617	5.66
2	A	3567	3420	0.30
3	A	3477	3333	1.23
4	A	3124	2995	36.07
5	A	3033	2908	71.70
6	A	1686	1617	20.48
7	A	1525	1462	0.35
8	A	1431	1371	41.75
9	A	1398	1340	1.77
10	A	1379	1322	3.09
11	A	1160	1112	21.79
12	A	1100	1055	23.15
13	A	1002	961	250.52
14	A	904	867	3.96
15	A	841	807	158.99
16	A	467	447	47.73
17	A	423	405	113.97
18	A	306	293	64.48

Atom	x (Å)	y (Å)	z (Å)
N1	1.236	-0.158	-0.020
C2	-0.030	0.535	0.048
O3	-1.208	-0.263	-0.117
H4	1.272	-0.720	-0.869
H5	1.341	-0.799	0.765
H6	-0.060	1.086	0.997
H7	-0.074	1.254	-0.773
H8	-1.293	-0.821	0.671

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4449	2.4482	1.0186	1.0188	2.0648	2.0686	2.7050
C2	1.4449		1.4329	2.0271	2.0428	1.0979	1.0920	1.9559
O3	2.4482	1.4329		2.6306	2.7497	2.0925	2.0046	0.9691
H4	1.0186	2.0271	2.6306		1.6371	2.9185	2.3915	2.9933
H5	1.0188	2.0428	2.7497	1.6371		2.3602	2.9298	2.6364
H6	2.0648	1.0979	2.0925	2.9185	2.3602		1.7781	2.2941
H7	2.0686	1.0920	2.0046	2.3915	2.9298	1.7781		2.8068
H8	2.7050	1.9559	0.9691	2.9933	2.6364	2.2941	2.8068

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	116.574	N1	C2	H6	107.811
N1	C2	H7	108.455	C2	N1	H4	109.528
C2	N1	H5	110.844	C2	O3	H8	107.454
O3	C2	H6	110.850	O3	C2	H7	104.295
H4	N1	H5	106.934	H6	C2	H7	108.576

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: TPSSh/6-31G**

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	-0.610
2	C	0.091
3	O	-0.541
4	H	0.258
5	H	0.244
6	H	0.115
7	H	0.142
8	H	0.300

	x	y	z	Total
	0.220	-1.190	1.283	1.764
CHELPG
AIM
ESP

	x	y	z
x	3.532	-0.117	-0.098
y	-0.117	3.305	-0.190
z	-0.098	-0.190	3.413

<r²>	49.795
(<r²>)^1/2	7.057

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: TPSSh/6-31G**

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)