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	hartrees
Energy at 0K	-133.784025
Energy at 298.15K	-133.789321
HF Energy	-133.784025
Nuclear repulsion energy	70.968962

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3610	3568	17.82
2	A	3494	3454	11.49
3	A	3200	3164	10.29
4	A	3107	3072	7.72
5	A	3099	3063	11.38
6	A	1667	1648	194.06
7	A	1603	1585	25.18
8	A	1404	1388	2.06
9	A	1296	1282	19.19
10	A	1252	1238	37.77
11	A	1050	1038	15.75
12	A	954	944	28.48
13	A	928	917	4.84
14	A	760	752	78.56
15	A	672	665	8.58
16	A	546	539	277.17
17	A	454	449	2.14
18	A	350	346	58.94

Atom	x (Å)	y (Å)	z (Å)
C1	1.262	-0.197	0.015
C2	0.065	0.431	0.001
N3	-1.190	-0.172	-0.081
H4	1.349	-1.288	0.022
H5	2.186	0.384	-0.003
H6	0.020	1.527	-0.013
H7	-1.221	-1.169	0.127
H8	-1.964	0.340	0.336

	C1	C2	N3	H4	H5	H6	H7	H8
C1		1.3522	2.4547	1.0948	1.0906	2.1247	2.6697	3.2867
C2	1.3522		1.3948	2.1458	2.1213	1.0965	2.0566	2.0585
N3	2.4547	1.3948		2.7757	3.4222	2.0862	1.0190	1.0171
H4	1.0948	2.1458	2.7757		1.8696	3.1128	2.5753	3.7048
H5	1.0906	2.1213	3.4222	1.8696		2.4490	3.7464	4.1640
H6	2.1247	1.0965	2.0862	3.1128	2.4490		2.9705	2.3379
H7	2.6697	2.0566	1.0190	2.5753	3.7464	2.9705		1.6944
H8	3.2867	2.0585	1.0171	3.7048	4.1640	2.3379	1.6944

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	126.657	C1	C2	H6	120.028
C2	C1	H4	122.195	C2	C1	H5	120.170
C2	N3	H7	115.992	C2	N3	H8	116.311
N3	C2	H6	113.193	H4	C1	H5	117.622
H7	N3	H8	112.643

All results from a given calculation for CH₂CHNH₂ (aminoethene)

using model chemistry: PBEPBE/6-31+G**

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	-0.416
2	C	-0.069
3	N	-0.523
4	H	0.132
5	H	0.147
6	H	0.142
7	H	0.292
8	H	0.293

	x	y	z	Total
	-1.440	-0.058	0.932	1.716
CHELPG
AIM
ESP

	x	y	z
x	7.537	-0.564	0.102
y	-0.564	4.780	-0.003
z	0.102	-0.003	4.044

<r²>	50.801
(<r²>)^1/2	7.127

All results from a given calculation for CH2CHNH2 (aminoethene)

using model chemistry: PBEPBE/6-31+G**

States and conformations

All results from a given calculation for CH₂CHNH₂ (aminoethene)