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	hartrees
Energy at 0K	-133.161086
Energy at 298.15K	-133.166265
HF Energy	-133.161086
Nuclear repulsion energy	71.432115

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3713	3569	30.13
2	A	3590	3451	36.44
3	A	3273	3146	13.97
4	A	3180	3057	1.71
5	A	3170	3047	16.54
6	A	1722	1655	205.36
7	A	1698	1632	23.02
8	A	1506	1448	0.95
9	A	1372	1319	18.31
10	A	1306	1255	43.41
11	A	1074	1032	23.93
12	A	1023	984	21.91
13	A	991	953	2.34
14	A	827	795	128.86
15	A	709	681	4.82
16	A	465	447	3.06
17	A	463	445	112.87
18	A	227	218	264.57

Atom	x (Å)	y (Å)	z (Å)
C1	-1.262	-0.192	0.000
C2	-0.067	0.420	0.000
N3	1.178	-0.171	-0.000
H4	-1.358	-1.274	0.001
H5	-2.175	0.389	-0.001
H6	-0.028	1.507	-0.001
H7	1.273	-1.177	-0.002
H8	2.018	0.386	0.002

	C1	C2	N3	H4	H5	H6	H7	H8
C1		1.3423	2.4399	1.0859	1.0823	2.1004	2.7194	3.3306
C2	1.3423		1.3781	2.1295	2.1080	1.0884	2.0847	2.0856
N3	2.4399	1.3781		2.7655	3.3993	2.0667	1.0106	1.0082
H4	1.0859	2.1295	2.7655		1.8526	3.0830	2.6328	3.7623
H5	1.0823	2.1080	3.3993	1.8526		2.4210	3.7868	4.1931
H6	2.1004	1.0884	2.0667	3.0830	2.4210		2.9831	2.3331
H7	2.7194	2.0847	1.0106	2.6328	3.7868	2.9831		1.7319
H8	3.3306	2.0856	1.0082	3.7623	4.1931	2.3331	1.7319

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	127.491	C1	C2	H6	119.195
C2	C1	H4	122.210	C2	C1	H5	120.401
C2	N3	H7	120.775	C2	N3	H8	121.063
N3	C2	H6	113.314	H4	C1	H5	117.389
H7	N3	H8	118.162

All results from a given calculation for CH₂CHNH₂ (aminoethene)

using model chemistry: B3PW91/3-21G

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	-0.496
2	C	0.054
3	N	-0.784
4	H	0.178
5	H	0.191
6	H	0.215
7	H	0.320
8	H	0.321

	x	y	z	Total
	2.003	0.030	0.000	2.003
CHELPG
AIM
ESP

	x	y	z
x	5.996	0.441	0.000
y	0.441	3.855	-0.000
z	0.000	-0.000	1.113

<r²>	49.797
(<r²>)^1/2	7.057

All results from a given calculation for CH2CHNH2 (aminoethene)

using model chemistry: B3PW91/3-21G

States and conformations

All results from a given calculation for CH₂CHNH₂ (aminoethene)