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	hartrees
Energy at 0K	-171.018083
Energy at 298.15K	-171.024646
HF Energy	-171.018083
Nuclear repulsion energy	82.382800

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3886	3717	23.88
2	A	3672	3513	7.08
3	A	3572	3417	1.57
4	A	3157	3020	26.24
5	A	3070	2937	57.07
6	A	1678	1605	40.31
7	A	1509	1443	0.10
8	A	1425	1364	41.25
9	A	1388	1328	1.71
10	A	1363	1304	5.62
11	A	1165	1115	65.32
12	A	1113	1064	25.77
13	A	1028	984	240.73
14	A	907	867	3.24
15	A	792	758	182.41
16	A	481	460	51.53
17	A	413	395	103.96
18	A	291	278	96.89

Atom	x (Å)	y (Å)	z (Å)
N1	1.220	-0.159	-0.019
C2	-0.030	0.530	0.048
O3	-1.200	-0.262	-0.117
H4	1.309	-0.690	-0.876
H5	1.376	-0.776	0.768
H6	-0.068	1.074	0.998
H7	-0.077	1.254	-0.765
H8	-1.303	-0.833	0.650

	N1	C2	O3	H4	H5	H6	H7	H8
N1		1.4296	2.4238	1.0117	1.0114	2.0536	2.0584	2.6960
C2	1.4296		1.4221	2.0342	2.0496	1.0949	1.0897	1.9600
O3	2.4238	1.4221		2.6559	2.7714	2.0754	1.9950	0.9616
H4	1.0117	2.0342	2.6559		1.6470	2.9193	2.3906	3.0286
H5	1.0114	2.0496	2.7714	1.6470		2.3586	2.9292	2.6826
H6	2.0536	1.0949	2.0754	2.9193	2.3586		1.7717	2.2989
H7	2.0584	1.0897	1.9950	2.3906	2.9292	1.7717		2.8042
H8	2.6960	1.9600	0.9616	3.0286	2.6826	2.2989	2.8042

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
N1	C2	O3	116.416	N1	C2	H6	108.133
N1	C2	H7	108.829	C2	N1	H4	111.719
C2	N1	H5	113.093	C2	O3	H8	109.095
O3	C2	H6	110.413	O3	C2	H7	104.387
H4	N1	H5	108.997	H6	C2	H7	108.376

All results from a given calculation for NH₂CH₂OH (aminomethanol)

using model chemistry: B1B95/6-31+G**

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	-0.657
2	C	-0.061
3	O	-0.509
4	H	0.305
5	H	0.291
6	H	0.136
7	H	0.156
8	H	0.339

	x	y	z	Total
	0.428	-1.127	1.399	1.847
CHELPG
AIM
ESP

	x	y	z
x	4.472	0.030	-0.043
y	0.030	3.924	-0.047
z	-0.043	-0.047	3.679

<r²>	49.818
(<r²>)^1/2	7.058

All results from a given calculation for NH2CH2OH (aminomethanol)

using model chemistry: B1B95/6-31+G**

States and conformations

All results from a given calculation for NH₂CH₂OH (aminomethanol)