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	hartrees
Energy at 0K	-170.919850
Energy at 298.15K	-170.926246
HF Energy	-170.919850
Nuclear repulsion energy	80.577231

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3632	3632	1.94
2	A	3511	3511	4.33
3	A	3506	3506	1.08
4	A	3101	3101	35.82
5	A	2992	2992	78.72
6	A	1689	1689	33.68
7	A	1504	1504	0.54
8	A	1407	1407	21.78
9	A	1365	1365	4.66
10	A	1328	1328	4.52
11	A	1147	1147	63.04
12	A	1090	1090	28.53
13	A	887	887	12.28
14	A	842	842	220.97
15	A	592	592	232.75
16	A	440	440	69.28
17	A	425	425	137.68
18	A	299	299	124.35

Atom	x (Å)	y (Å)	z (Å)
N1	1.226	-0.184	-0.026
C2	-0.007	0.541	0.048
O3	-1.257	-0.255	-0.109
H4	1.412	-0.667	-0.898
H5	1.521	-0.697	0.798
H6	-0.031	1.092	1.002
H7	-0.077	1.250	-0.781
H8	-1.314	-0.890	0.644

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4319	2.4851	1.0141	1.0141	2.0652	2.0802	2.7200
C2	1.4319		1.4903	2.0899	2.1038	1.1016	1.0944	2.0274
O3	2.4851	1.4903		2.8136	2.9548	2.1334	2.0276	0.9862
H4	1.0141	2.0899	2.8136		1.6998	2.9642	2.4305	3.1403
H5	1.0141	2.1038	2.9548	1.6998		2.3769	2.9732	2.8454
H6	2.0652	1.1016	2.1334	2.9642	2.3769		1.7911	2.3879
H7	2.0802	1.0944	2.0276	2.4305	2.9732	1.7911		2.8536
H8	2.7200	2.0274	0.9862	3.1403	2.8454	2.3879	2.8536

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	116.499	N1	C2	H6	108.500
N1	C2	H7	110.141	C2	N1	H4	116.346
C2	N1	H5	117.640	C2	O3	H8	108.171
O3	C2	H6	109.886	O3	C2	H7	102.258
H4	N1	H5	113.874	H6	C2	H7	109.298

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: B97D3/6-31G

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	-0.677
2	C	0.028
3	O	-0.582
4	H	0.299
5	H	0.288
6	H	0.143
7	H	0.174
8	H	0.327

	x	y	z	Total
	1.273	-1.202	1.437	2.265
CHELPG
AIM
ESP

	x	y	z
x	3.713	-0.073	-0.072
y	-0.073	3.021	-0.253
z	-0.072	-0.253	3.224

<r²>	51.487
(<r²>)^1/2	7.175

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: B97D3/6-31G

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)