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	hartrees
Energy at 0K	-170.938061
Energy at 298.15K	-170.944453
HF Energy	-170.938061
Nuclear repulsion energy	81.571862

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3776	3602	10.36
2	A	3684	3514	1.93
3	A	3647	3478	5.31
4	A	3183	3036	32.18
5	A	3082	2939	68.22
6	A	1719	1640	45.51
7	A	1543	1471	1.01
8	A	1446	1379	24.26
9	A	1396	1332	3.14
10	A	1356	1293	11.21
11	A	1194	1139	95.41
12	A	1129	1077	11.22
13	A	945	902	229.96
14	A	904	862	4.26
15	A	579	552	219.85
16	A	432	412	121.92
17	A	421	401	119.14
18	A	273	260	174.16

Atom	x (Å)	y (Å)	z (Å)
N1	1.203	-0.188	-0.026
C2	-0.016	0.533	0.045
O3	-1.237	-0.253	-0.103
H4	1.436	-0.637	-0.894
H5	1.559	-0.635	0.801
H6	-0.039	1.086	0.989
H7	-0.086	1.243	-0.776
H8	-1.295	-0.914	0.611

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4183	2.4422	1.0049	1.0046	2.0485	2.0667	2.6779
C2	1.4183		1.4596	2.0878	2.1013	1.0943	1.0877	2.0118
O3	2.4422	1.4596		2.8137	2.9628	2.1026	2.0042	0.9745
H4	1.0049	2.0878	2.8137		1.6992	2.9480	2.4212	3.1301
H5	1.0046	2.1013	2.9628	1.6992		2.3563	2.9524	2.8731
H6	2.0485	1.0943	2.1026	2.9480	2.3563		1.7726	2.3911
H7	2.0667	1.0877	2.0042	2.4212	2.9524	1.7726		2.8349
H8	2.6779	2.0118	0.9745	3.1301	2.8731	2.3911	2.8349

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	116.119	N1	C2	H6	108.552
N1	C2	H7	110.421	C2	N1	H4	117.989
C2	N1	H5	119.307	C2	O3	H8	109.880
O3	C2	H6	110.013	O3	C2	H7	102.801
H4	N1	H5	115.465	H6	C2	H7	108.654

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: B1B95/6-31G

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	-0.741
2	C	0.042
3	O	-0.618
4	H	0.318
5	H	0.309
6	H	0.155
7	H	0.188
8	H	0.347

	x	y	z	Total
	1.450	-1.131	1.482	2.362
CHELPG
AIM
ESP

	x	y	z
x	3.391	-0.080	-0.042
y	-0.080	2.869	-0.232
z	-0.042	-0.232	3.055

<r²>	50.484
(<r²>)^1/2	7.105

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: B1B95/6-31G

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)