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	hartrees
Energy at 0K	-24.158474
Energy at 298.15K	-24.163584
HF Energy	-24.158474
Nuclear repulsion energy	40.487134

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3745	3650	12.94
2	A	3597	3506	23.44
3	A	3226	3144	34.49
4	A	3139	3059	13.77
5	A	3112	3033	15.11
6	A	1689	1646	223.96
7	A	1662	1619	53.35
8	A	1457	1420	1.34
9	A	1332	1298	31.35
10	A	1273	1241	52.89
11	A	1045	1018	28.83
12	A	994	969	26.16
13	A	957	933	3.37
14	A	812	792	117.81
15	A	688	670	12.93
16	A	452	440	1.83
17	A	413	402	98.65
18	A	231	225	252.29

Atom	x (Å)	y (Å)	z (Å)
C1	-1.277	-0.198	0.000
C2	-0.070	0.434	0.000
N3	1.192	-0.176	-0.000
H4	-1.365	-1.284	0.000
H5	-2.194	0.381	-0.000
H6	-0.025	1.524	-0.000
H7	1.281	-1.181	-0.001
H8	2.035	0.376	0.001

	C1	C2	N3	H4	H5	H6	H7	H8
C1		1.3623	2.4692	1.0894	1.0851	2.1292	2.7400	3.3608
C2	1.3623		1.4021	2.1516	2.1246	1.0906	2.1058	2.1056
N3	2.4692	1.4021		2.7872	3.4320	2.0906	1.0091	1.0069
H4	1.0894	2.1516	2.7872		1.8603	3.1115	2.6480	3.7834
H5	1.0851	2.1246	3.4320	1.8603		2.4519	3.8100	4.2288
H6	2.1292	1.0906	2.0906	3.1115	2.4519		3.0035	2.3578
H7	2.7400	2.1058	1.0091	2.6480	3.8100	3.0035		1.7298
H8	3.3608	2.1056	1.0069	3.7834	4.2288	2.3578	1.7298

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	126.546	C1	C2	H6	120.046
C2	C1	H4	122.312	C2	C1	H5	120.055
C2	N3	H7	120.827	C2	N3	H8	120.983
N3	C2	H6	113.408	H4	C1	H5	117.633
H7	N3	H8	118.190

All results from a given calculation for CH₂CHNH₂ (aminoethene)

using model chemistry: B3LYP/CEP-121G

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	-0.460
2	C	0.097
3	N	-0.569
4	H	0.107
5	H	0.116
6	H	0.117
7	H	0.294
8	H	0.297

	x	y	z	Total
	1.900	0.052	0.001	1.901
CHELPG
AIM
ESP

	x	y	z
x	6.897	0.609	0.000
y	0.609	4.423	0.000
z	0.000	0.000	2.569

<r²>	44.425
(<r²>)^1/2	6.665

All results from a given calculation for CH2CHNH2 (aminoethene)

using model chemistry: B3LYP/CEP-121G

States and conformations

All results from a given calculation for CH₂CHNH₂ (aminoethene)