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	hartrees
Energy at 0K	-133.912878
Energy at 298.15K	-133.918099
HF Energy	-133.912878
Nuclear repulsion energy	71.307723

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3775	3631	21.86
2	A	3644	3505	28.82
3	A	3273	3148	23.40
4	A	3184	3063	7.95
5	A	3174	3054	16.37
6	A	1734	1668	214.90
7	A	1702	1637	24.44
8	A	1497	1440	1.04
9	A	1372	1320	18.56
10	A	1308	1258	47.71
11	A	1078	1037	25.22
12	A	1018	979	18.33
13	A	984	947	3.24
14	A	838	806	109.49
15	A	705	678	2.84
16	A	464	447	1.99
17	A	451	433	169.55
18	A	272	262	235.19

Atom	x (Å)	y (Å)	z (Å)
C1	1.263	-0.194	0.000
C2	0.069	0.427	-0.000
N3	-1.180	-0.173	-0.000
H4	1.355	-1.277	-0.000
H5	2.181	0.378	-0.000
H6	0.023	1.514	-0.000
H7	-1.271	-1.175	-0.000
H8	-2.021	0.374	0.002

	C1	C2	N3	H4	H5	H6	H7	H8
C1		1.3460	2.4423	1.0864	1.0824	2.1110	2.7167	3.3324
C2	1.3460		1.3853	2.1349	2.1128	1.0878	2.0886	2.0904
N3	2.4423	1.3853		2.7643	3.4056	2.0719	1.0061	1.0037
H4	1.0864	2.1349	2.7643		1.8501	3.0926	2.6277	3.7579
H5	1.0824	2.1128	3.4056	1.8501		2.4388	3.7854	4.2020
H6	2.1110	1.0878	2.0719	3.0926	2.4388		2.9842	2.3401
H7	2.7167	2.0886	1.0061	2.6277	3.7854	2.9842		1.7213
H8	3.3324	2.0904	1.0037	3.7579	4.2020	2.3401	1.7213

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	126.805	C1	C2	H6	119.934
C2	C1	H4	122.377	C2	C1	H5	120.539
C2	N3	H7	120.892	C2	N3	H8	121.267
N3	C2	H6	113.261	H4	C1	H5	117.084
H7	N3	H8	117.841

All results from a given calculation for CH₂CHNH₂ (aminoethene)

using model chemistry: B3LYP/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	C	-0.348
2	C	0.143
3	N	-0.750
4	H	0.098
5	H	0.111
6	H	0.124
7	H	0.311
8	H	0.311

	x	y	z	Total
	-1.822	0.036	0.001	1.822
CHELPG
AIM
ESP

	x	y	z
x	6.291	-0.474	0.001
y	-0.474	4.078	0.000
z	0.001	0.000	1.428

<r²>	50.067
(<r²>)^1/2	7.076

All results from a given calculation for CH2CHNH2 (aminoethene)

using model chemistry: B3LYP/6-31G

States and conformations

All results from a given calculation for CH₂CHNH₂ (aminoethene)