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	hartrees
Energy at 0K	-171.150033
Energy at 298.15K	-171.156539
HF Energy	-171.150033
Nuclear repulsion energy	81.967478

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3796	3796	16.22
2	A	3572	3572	2.61
3	A	3489	3489	1.52
4	A	3103	3103	25.06
5	A	3027	3027	51.26
6	A	1666	1666	26.53
7	A	1513	1513	0.05
8	A	1417	1417	30.59
9	A	1384	1384	1.97
10	A	1359	1359	4.79
11	A	1148	1148	33.33
12	A	1086	1086	28.02
13	A	972	972	240.30
14	A	898	898	2.98
15	A	797	797	147.93
16	A	467	467	45.65
17	A	392	392	82.78
18	A	276	276	69.28

Atom	x (Å)	y (Å)	z (Å)
N1	1.230	-0.160	-0.020
C2	-0.027	0.536	0.048
O3	-1.208	-0.263	-0.116
H4	1.299	-0.709	-0.871
H5	1.366	-0.783	0.769
H6	-0.068	1.077	0.998
H7	-0.077	1.253	-0.770
H8	-1.305	-0.830	0.657

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4387	2.4413	1.0148	1.0145	2.0612	2.0658	2.7075
C2	1.4387		1.4348	2.0379	2.0500	1.0938	1.0891	1.9672
O3	2.4413	1.4348		2.6552	2.7712	2.0825	2.0016	0.9641
H4	1.0148	2.0379	2.6552		1.6433	2.9236	2.3984	3.0213
H5	1.0145	2.0500	2.7712	1.6433		2.3591	2.9322	2.6738
H6	2.0612	1.0938	2.0825	2.9236	2.3591		1.7769	2.2985
H7	2.0658	1.0891	2.0016	2.3984	2.9322	1.7769		2.8084
H8	2.7075	1.9672	0.9641	3.0213	2.6738	2.2985	2.8084

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	116.337	N1	C2	H6	108.189
N1	C2	H7	108.833	C2	N1	H4	111.149
C2	N1	H5	112.208	C2	O3	H8	108.579
O3	C2	H6	110.159	O3	C2	H7	104.107
H4	N1	H5	108.153	H6	C2	H7	108.986

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: TPSSh/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	N	-0.766
2	C	0.728
3	O	-0.573
4	H	0.163
5	H	0.157
6	H	0.063
7	H	0.059
8	H	0.171

	x	y	z	Total
	0.400	-0.970	1.247	1.630
CHELPG
AIM
ESP

	x	y	z
x	5.116	0.040	-0.062
y	0.040	4.431	-0.042
z	-0.062	-0.042	4.113

<r²>	50.168
(<r²>)^1/2	7.083

All results from a given calculation for NH2CH2OH (aminomethanol)

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

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)