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	hartrees
Energy at 0K	-171.052834
Energy at 298.15K	-171.059299
HF Energy	-171.052834
Nuclear repulsion energy	81.724149

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3751	3702	13.35
2	A	3530	3484	2.37
3	A	3444	3399	1.53
4	A	3045	3006	27.96
5	A	2967	2928	56.98
6	A	1634	1613	25.62
7	A	1473	1453	0.08
8	A	1389	1371	29.34
9	A	1356	1338	2.06
10	A	1334	1316	3.91
11	A	1133	1118	27.82
12	A	1064	1050	29.75
13	A	927	915	242.30
14	A	891	879	2.76
15	A	774	764	150.46
16	A	466	460	44.75
17	A	390	385	80.48
18	A	268	265	68.20

Atom	x (Å)	y (Å)	z (Å)
N1	1.234	-0.161	-0.021
C2	-0.025	0.536	0.048
O3	-1.214	-0.263	-0.116
H4	1.301	-0.713	-0.871
H5	1.371	-0.782	0.771
H6	-0.063	1.081	1.001
H7	-0.076	1.258	-0.772
H8	-1.301	-0.834	0.657

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4408	2.4518	1.0161	1.0158	2.0657	2.0716	2.7086
C2	1.4408		1.4416	2.0405	2.0523	1.0982	1.0931	1.9689
O3	2.4518	1.4416		2.6644	2.7822	2.0917	2.0097	0.9652
H4	1.0161	2.0405	2.6644		1.6455	2.9296	2.4058	3.0199
H5	1.0158	2.0523	2.7822	1.6455		2.3623	2.9387	2.6749
H6	2.0657	1.0982	2.0917	2.9296	2.3623		1.7816	2.3056
H7	2.0716	1.0931	2.0097	2.4058	2.9387	1.7816		2.8143
H8	2.7086	1.9689	0.9652	3.0199	2.6749	2.3056	2.8143

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	116.550	N1	C2	H6	108.140
N1	C2	H7	108.904	C2	N1	H4	111.124
C2	N1	H5	112.160	C2	O3	H8	108.142
O3	C2	H6	110.155	O3	C2	H7	104.056
H4	N1	H5	108.155	H6	C2	H7	108.781

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: B97D3/6-311+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	-0.751
2	C	0.581
3	O	-0.559
4	H	0.184
5	H	0.178
6	H	0.092
7	H	0.087
8	H	0.189

	x	y	z	Total
	0.443	-0.979	1.224	1.629
CHELPG
AIM
ESP

	x	y	z
x	5.349	0.048	-0.069
y	0.048	4.583	-0.033
z	-0.069	-0.033	4.224

<r²>	50.480
(<r²>)^1/2	7.105

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: B97D3/6-311+G(3df,2p)

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)