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	hartrees
Energy at 0K	-133.870136
Energy at 298.15K	-133.875614
HF Energy	-133.870136
Nuclear repulsion energy	71.518034

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3680	3485	11.81
2	A	3576	3387	10.34
3	A	3292	3118	9.96
4	A	3204	3034	7.35
5	A	3193	3023	10.40
6	A	1771	1677	131.27
7	A	1686	1597	31.60
8	A	1470	1392	2.14
9	A	1349	1277	5.89
10	A	1310	1241	32.37
11	A	1101	1042	12.65
12	A	1022	968	19.31
13	A	970	919	1.69
14	A	846	801	78.79
15	A	753	713	105.89
16	A	642	608	224.78
17	A	471	446	4.61
18	A	367	347	56.76

Atom	x (Å)	y (Å)	z (Å)
C1	1.246	-0.198	0.018
C2	0.070	0.432	-0.002
N3	-1.187	-0.167	-0.093
H4	1.314	-1.282	0.026
H5	2.171	0.364	0.002
H6	0.030	1.519	-0.017
H7	-1.185	-1.155	0.132
H8	-1.918	0.317	0.411

	C1	C2	N3	H4	H5	H6	H7	H8
C1		1.3342	2.4352	1.0863	1.0822	2.1042	2.6152	3.2299
C2	1.3342		1.3951	2.1185	2.1020	1.0879	2.0280	2.0342
N3	2.4352	1.3951		2.7410	3.4005	2.0808	1.0133	1.0119
H4	1.0863	2.1185	2.7410		1.8552	3.0819	2.5050	3.6271
H5	1.0822	2.1020	3.4005	1.8552		2.4327	3.6859	4.1100
H6	2.1042	1.0879	2.0808	3.0819	2.4327		2.9414	2.3295
H7	2.6152	2.0280	1.0133	2.5050	3.6859	2.9414		1.6683
H8	3.2299	2.0342	1.0119	3.6271	4.1100	2.3295	1.6683

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	126.299	C1	C2	H6	120.282
C2	C1	H4	121.805	C2	C1	H5	120.535
C2	N3	H7	113.772	C2	N3	H8	114.426
N3	C2	H6	113.290	H4	C1	H5	117.643
H7	N3	H8	110.920

All results from a given calculation for CH₂CHNH₂ (aminoethene)

using model chemistry: M06-2X/6-31G*

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	-0.420
2	C	0.064
3	N	-0.771
4	H	0.139
5	H	0.155
6	H	0.161
7	H	0.335
8	H	0.337

	x	y	z	Total
	-1.041	-0.044	1.191	1.583
CHELPG
AIM
ESP

	x	y	z
x	6.173	-0.480	-0.066
y	-0.480	4.213	0.003
z	-0.066	0.003	1.848

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for CH2CHNH2 (aminoethene)

using model chemistry: M06-2X/6-31G*

States and conformations

All results from a given calculation for CH₂CHNH₂ (aminoethene)