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	hartrees
Energy at 0K	-171.095955
Energy at 298.15K	-171.102501
HF Energy	-171.095955
Nuclear repulsion energy	81.728405

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3785	3643	14.49
2	A	3600	3465	2.97
3	A	3504	3372	0.77
4	A	3141	3023	27.27
5	A	3052	2937	58.07
6	A	1682	1619	34.79
7	A	1517	1461	0.02
8	A	1421	1368	38.45
9	A	1387	1335	2.37
10	A	1356	1305	3.29
11	A	1147	1104	43.56
12	A	1088	1047	30.27
13	A	974	938	268.52
14	A	899	865	3.18
15	A	799	769	172.36
16	A	469	451	46.34
17	A	415	399	104.36
18	A	296	285	90.55

Atom	x (Å)	y (Å)	z (Å)
N1	1.232	-0.162	-0.019
C2	-0.026	0.536	0.049
O3	-1.212	-0.263	-0.118
H4	1.311	-0.701	-0.877
H5	1.378	-0.785	0.771
H6	-0.065	1.077	1.001
H7	-0.075	1.253	-0.772
H8	-1.319	-0.827	0.663

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4404	2.4488	1.0169	1.0168	2.0636	2.0679	2.7236
C2	1.4404		1.4401	2.0437	2.0585	1.0962	1.0909	1.9768
O3	2.4488	1.4401		2.6713	2.7877	2.0896	2.0052	0.9690
H4	1.0169	2.0437	2.6713		1.6517	2.9301	2.3980	3.0503
H5	1.0168	2.0585	2.7877	1.6517		2.3669	2.9400	2.6995
H6	2.0636	1.0962	2.0896	2.9301	2.3669		1.7820	2.3056
H7	2.0679	1.0909	2.0052	2.3980	2.9400	1.7820		2.8168
H8	2.7236	1.9768	0.9690	3.0503	2.6995	2.3056	2.8168

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	116.449	N1	C2	H6	108.114
N1	C2	H7	108.772	C2	N1	H4	111.369
C2	N1	H5	112.667	C2	O3	H8	108.702
O3	C2	H6	110.210	O3	C2	H7	103.936
H4	N1	H5	108.611	H6	C2	H7	109.137

All results from a given calculation for NH₂CH₂OH (aminomethanol)

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

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	-0.642
2	C	-0.088
3	O	-0.499
4	H	0.306
5	H	0.291
6	H	0.138
7	H	0.158
8	H	0.336

	x	y	z	Total
	0.430	-1.083	1.400	1.821
CHELPG
AIM
ESP

	x	y	z
x	4.713	0.041	-0.047
y	0.041	4.023	-0.047
z	-0.047	-0.047	3.779

<r²>	50.522
(<r²>)^1/2	7.108

All results from a given calculation for NH2CH2OH (aminomethanol)

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

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)