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	hartrees
Energy at 0K	-170.919622
Energy at 298.15K	-170.926279
HF Energy	-170.919622
Nuclear repulsion energy	82.467716

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3834	3674	6.75
2	A	3625	3475	0.46
3	A	3540	3393	0.78
4	A	3139	3009	34.72
5	A	3046	2920	72.74
6	A	1728	1656	36.93
7	A	1514	1451	0.28
8	A	1447	1387	47.21
9	A	1411	1352	1.96
10	A	1396	1338	2.51
11	A	1186	1137	34.75
12	A	1127	1081	28.14
13	A	1045	1001	250.94
14	A	924	886	3.11
15	A	850	815	174.66
16	A	485	465	56.54
17	A	437	419	125.76
18	A	319	306	78.52

Atom	x (Å)	y (Å)	z (Å)
N1	1.222	-0.157	-0.022
C2	-0.032	0.531	0.047
O3	-1.197	-0.262	-0.114
H4	1.274	-0.714	-0.866
H5	1.356	-0.778	0.768
H6	-0.063	1.082	0.996
H7	-0.080	1.256	-0.768
H8	-1.278	-0.838	0.651

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4327	2.4230	1.0129	1.0129	2.0547	2.0610	2.6771
C2	1.4327		1.4177	2.0220	2.0395	1.0975	1.0912	1.9469
O3	2.4230	1.4177		2.6216	2.7492	2.0786	1.9945	0.9608
H4	1.0129	2.0220	2.6216		1.6374	2.9115	2.3915	2.9711
H5	1.0129	2.0395	2.7492	1.6374		2.3499	2.9244	2.6369
H6	2.0547	1.0975	2.0786	2.9115	2.3499		1.7719	2.2978
H7	2.0610	1.0912	1.9945	2.3915	2.9244	1.7719		2.7984
H8	2.6771	1.9469	0.9608	2.9711	2.6369	2.2978	2.7984

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	116.439	N1	C2	H6	107.861
N1	C2	H7	108.742	C2	N1	H4	110.368
C2	N1	H5	111.864	C2	O3	H8	108.343
O3	C2	H6	110.826	O3	C2	H7	104.554
H4	N1	H5	107.855	H6	C2	H7	108.112

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: PBE1PBE/6-311G*

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	-0.127
3	O	-0.559
4	H	0.325
5	H	0.311
6	H	0.206
7	H	0.229
8	H	0.367

	x	y	z	Total
	0.308	-1.287	1.385	1.916
CHELPG
AIM
ESP

	x	y	z
x	3.650	-0.070	-0.095
y	-0.070	3.428	-0.165
z	-0.095	-0.165	3.420

<r²>	49.409
(<r²>)^1/2	7.029

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: PBE1PBE/6-311G*

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)