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	hartrees
Energy at 0K	-133.125813
Energy at 298.15K	-133.131409
HF Energy	-133.125813
Nuclear repulsion energy	72.204574

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3881	3518	19.42
2	A	3781	3427	18.04
3	A	3379	3063	16.88
4	A	3312	3002	9.21
5	A	3284	2977	8.69
6	A	1845	1673	187.97
7	A	1788	1620	25.13
8	A	1573	1426	1.79
9	A	1439	1304	6.07
10	A	1383	1253	55.24
11	A	1151	1043	13.81
12	A	1114	1009	25.99
13	A	1037	940	9.57
14	A	956	866	94.88
15	A	790	716	38.22
16	A	650	589	268.53
17	A	501	454	4.20
18	A	351	319	53.46

Atom	x (Å)	y (Å)	z (Å)
C1	1.235	-0.198	0.018
C2	0.074	0.427	-0.007
N3	-1.181	-0.163	-0.088
H4	1.305	-1.271	0.025
H5	2.149	0.359	0.014
H6	0.045	1.501	-0.017
H7	-1.195	-1.135	0.123
H8	-1.893	0.322	0.408

	C1	C2	N3	H4	H5	H6	H7	H8
C1		1.3182	2.4185	1.0749	1.0710	2.0748	2.6062	3.1945
C2	1.3182		1.3897	2.0971	2.0761	1.0750	2.0170	2.0134
N3	2.4185	1.3897		2.7243	3.3727	2.0689	0.9948	0.9940
H4	1.0749	2.0971	2.7243		1.8354	3.0453	2.5058	3.5933
H5	1.0710	2.0761	3.3727	1.8354		2.3943	3.6645	4.0615
H6	2.0748	1.0750	2.0689	3.0453	2.3943		2.9172	2.3085
H7	2.6062	2.0170	0.9948	2.5058	3.6645	2.9172		1.6405
H8	3.1945	2.0134	0.9940	3.5933	4.0615	2.3085	1.6405

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	126.518	C1	C2	H6	119.863
C2	C1	H4	122.074	C2	C1	H5	120.326
C2	N3	H7	114.515	C2	N3	H8	114.243
N3	C2	H6	113.544	H4	C1	H5	117.592
H7	N3	H8	111.145

All results from a given calculation for CH₂CHNH₂ (aminoethene)

using model chemistry: HF/Def2TZVPP

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	-0.212
2	C	0.095
3	N	-0.377
4	H	0.036
5	H	0.067
6	H	0.064
7	H	0.164
8	H	0.164

	x	y	z	Total
	-1.122	0.046	1.008	1.509
CHELPG
AIM
ESP

	x	y	z
x	6.664	-0.657	-0.013
y	-0.657	4.532	-0.011
z	-0.013	-0.011	3.494

<r²>	49.306
(<r²>)^1/2	7.022

All results from a given calculation for CH2CHNH2 (aminoethene)

using model chemistry: HF/Def2TZVPP

States and conformations

All results from a given calculation for CH₂CHNH₂ (aminoethene)