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	hartrees
Energy at 0K	-133.134085
Energy at 298.15K	-133.139295
HF Energy	-133.134085
Nuclear repulsion energy	71.642501

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3732	3571	30.98
2	A	3608	3452	37.52
3	A	3296	3153	13.74
4	A	3203	3065	0.71
5	A	3195	3057	16.62
6	A	1737	1662	200.13
7	A	1704	1630	34.16
8	A	1512	1446	1.12
9	A	1377	1317	16.39
10	A	1311	1254	46.33
11	A	1079	1032	25.35
12	A	1032	988	20.28
13	A	993	950	2.27
14	A	841	804	128.93
15	A	713	682	3.70
16	A	467	447	126.79
17	A	463	443	2.22
18	A	241	231	254.41

Atom	x (Å)	y (Å)	z (Å)
C1	1.257	-0.192	0.000
C2	0.068	0.420	0.000
N3	-1.174	-0.171	-0.000
H4	1.350	-1.271	0.000
H5	2.169	0.385	0.000
H6	0.029	1.504	0.000
H7	-1.267	-1.174	0.000
H8	-2.013	0.384	0.000

	C1	C2	N3	H4	H5	H6	H7	H8
C1		1.3376	2.4315	1.0828	1.0791	2.0945	2.7090	3.3206
C2	1.3376		1.3751	2.1219	2.1017	1.0851	2.0794	2.0811
N3	2.4315	1.3751		2.7535	3.3892	2.0619	1.0080	1.0055
H4	1.0828	2.1219	2.7535		1.8473	3.0736	2.6192	3.7480
H5	1.0791	2.1017	3.3892	1.8473		2.4157	3.7738	4.1822
H6	2.0945	1.0851	2.0619	3.0736	2.4157		2.9755	2.3288
H7	2.7090	2.0794	1.0080	2.6192	3.7738	2.9755		1.7272
H8	3.3206	2.0811	1.0055	3.7480	4.1822	2.3288	1.7272

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	127.352	C1	C2	H6	119.296
C2	C1	H4	122.135	C2	C1	H5	120.460
C2	N3	H7	120.738	C2	N3	H8	121.115
N3	C2	H6	113.352	H4	C1	H5	117.406
H7	N3	H8	118.148

All results from a given calculation for CH₂CHNH₂ (aminoethene)

using model chemistry: B1B95/3-21G

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	-0.484
2	C	0.057
3	N	-0.786
4	H	0.175
5	H	0.188
6	H	0.213
7	H	0.319
8	H	0.319

	x	y	z	Total
	-1.961	0.040	0.001	1.961
CHELPG
AIM
ESP

	x	y	z
x	5.954	-0.447	0.000
y	-0.447	3.837	0.000
z	0.000	0.000	1.107

<r²>	49.555
(<r²>)^1/2	7.040

All results from a given calculation for CH2CHNH2 (aminoethene)

using model chemistry: B1B95/3-21G

States and conformations

All results from a given calculation for CH₂CHNH₂ (aminoethene)