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	hartrees
Energy at 0K	-171.118401
Energy at 298.15K	-171.125029
HF Energy	-171.118401
Nuclear repulsion energy	82.024479

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3768	3641	4.04
2	A	3572	3452	0.38
3	A	3492	3374	1.55
4	A	3116	3011	36.11
5	A	3025	2923	74.02
6	A	1722	1664	33.74
7	A	1515	1464	0.12
8	A	1443	1394	42.20
9	A	1405	1358	2.25
10	A	1389	1342	3.08
11	A	1175	1135	26.24
12	A	1100	1063	28.56
13	A	1002	968	266.11
14	A	922	891	2.86
15	A	842	814	167.15
16	A	478	462	53.44
17	A	433	418	122.48
18	A	317	306	76.06

Atom	x (Å)	y (Å)	z (Å)
N1	1.231	-0.159	-0.022
C2	-0.030	0.535	0.047
O3	-1.206	-0.263	-0.114
H4	1.281	-0.718	-0.867
H5	1.363	-0.780	0.770
H6	-0.062	1.086	0.995
H7	-0.079	1.255	-0.771
H8	-1.288	-0.840	0.654

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4410	2.4403	1.0150	1.0150	2.0620	2.0673	2.6955
C2	1.4410		1.4298	2.0315	2.0481	1.0966	1.0902	1.9605
O3	2.4403	1.4298		2.6384	2.7655	2.0873	2.0008	0.9645
H4	1.0150	2.0315	2.6384		1.6405	2.9196	2.3979	2.9889
H5	1.0150	2.0481	2.7655	1.6405		2.3583	2.9315	2.6546
H6	2.0620	1.0966	2.0873	2.9196	2.3583		1.7740	2.3088
H7	2.0673	1.0902	2.0008	2.3979	2.9315	1.7740		2.8074
H8	2.6955	1.9605	0.9645	2.9889	2.6546	2.3088	2.8074

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	116.430	N1	C2	H6	107.931
N1	C2	H7	108.724	C2	N1	H4	110.417
C2	N1	H5	111.834	C2	O3	H8	108.362
O3	C2	H6	110.731	O3	C2	H7	104.309
H4	N1	H5	107.830	H6	C2	H7	108.434

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: B3LYP/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	-0.717
2	C	-0.101
3	O	-0.551
4	H	0.311
5	H	0.298
6	H	0.192
7	H	0.214
8	H	0.355

	x	y	z	Total
	0.338	-1.236	1.375	1.879
CHELPG
AIM
ESP

	x	y	z
x	3.746	-0.066	-0.110
y	-0.066	3.479	-0.175
z	-0.110	-0.175	3.471

<r²>	49.946
(<r²>)^1/2	7.067

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: B3LYP/6-311G*

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)