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	hartrees
Energy at 0K	-133.209920
Energy at 298.15K	-133.215011
HF Energy	-133.209920
Nuclear repulsion energy	71.371543

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3682	3552	24.10
2	A	3561	3436	30.47
3	A	3261	3147	15.89
4	A	3172	3060	2.32
5	A	3163	3052	17.56
6	A	1716	1655	201.49
7	A	1698	1639	16.21
8	A	1513	1460	1.62
9	A	1375	1326	16.76
10	A	1300	1254	46.03
11	A	1067	1030	24.33
12	A	1024	988	19.13
13	A	991	957	4.30
14	A	824	795	112.68
15	A	707	682	4.52
16	A	465	449	2.18
17	A	454	438	92.73
18	A	174	168	272.24

Atom	x (Å)	y (Å)	z (Å)
C1	-1.263	-0.193	0.000
C2	-0.069	0.421	-0.000
N3	1.180	-0.171	-0.000
H4	-1.356	-1.274	0.000
H5	-2.177	0.384	-0.000
H6	-0.029	1.508	-0.000
H7	1.275	-1.178	0.000
H8	2.020	0.387	0.000

	C1	C2	N3	H4	H5	H6	H7	H8
C1		1.3420	2.4422	1.0851	1.0814	2.1009	2.7225	3.3338
C2	1.3420		1.3821	2.1281	2.1084	1.0873	2.0893	2.0900
N3	2.4422	1.3821		2.7651	3.4025	2.0683	1.0114	1.0090
H4	1.0851	2.1281	2.7651		1.8500	3.0820	2.6334	3.7628
H5	1.0814	2.1084	3.4025	1.8500		2.4247	3.7896	4.1978
H6	2.1009	1.0873	2.0683	3.0820	2.4247		2.9855	2.3358
H7	2.7225	2.0893	1.0114	2.6334	3.7896	2.9855		1.7328
H8	3.3338	2.0900	1.0090	3.7628	4.1978	2.3358	1.7328

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	127.411	C1	C2	H6	119.357
C2	C1	H4	122.169	C2	C1	H5	120.547
C2	N3	H7	120.809	C2	N3	H8	121.084
N3	C2	H6	113.232	H4	C1	H5	117.284
H7	N3	H8	118.107

All results from a given calculation for CH₂CHNH₂ (aminoethene)

using model chemistry: B3LYP/3-21G

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	-0.445
2	C	0.077
3	N	-0.746
4	H	0.154
5	H	0.167
6	H	0.189
7	H	0.302
8	H	0.302

	x	y	z	Total
	1.973	0.031	0.001	1.973
CHELPG
AIM
ESP

	x	y	z
x	6.009	0.442	0.000
y	0.442	3.875	0.000
z	0.000	0.000	1.103

<r²>	49.932
(<r²>)^1/2	7.066

All results from a given calculation for CH2CHNH2 (aminoethene)

using model chemistry: B3LYP/3-21G

States and conformations

All results from a given calculation for CH₂CHNH₂ (aminoethene)