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	hartrees
Energy at 0K	-133.839463
Energy at 298.15K	-133.844761
HF Energy	-133.839463
Nuclear repulsion energy	71.600008

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3823	3646	27.99
2	A	3687	3517	34.50
3	A	3310	3157	20.27
4	A	3218	3069	6.73
5	A	3206	3058	15.18
6	A	1760	1679	219.81
7	A	1711	1632	36.49
8	A	1500	1430	0.85
9	A	1376	1313	19.44
10	A	1322	1261	46.37
11	A	1091	1041	25.09
12	A	1028	981	18.95
13	A	987	942	1.86
14	A	854	815	124.27
15	A	713	680	2.00
16	A	471	449	226.09
17	A	463	442	2.00
18	A	310	296	193.57

Atom	x (Å)	y (Å)	z (Å)
C1	-1.257	-0.194	0.000
C2	-0.067	0.425	-0.000
N3	1.174	-0.172	-0.000
H4	-1.350	-1.273	-0.000
H5	-2.172	0.380	0.000
H6	-0.024	1.509	0.000
H7	1.264	-1.171	0.001
H8	2.013	0.372	-0.000

	C1	C2	N3	H4	H5	H6	H7	H8
C1		1.3412	2.4314	1.0837	1.0798	2.1028	2.7044	3.3188
C2	1.3412		1.3775	2.1281	2.1055	1.0852	2.0784	2.0808
N3	2.4314	1.3775		2.7534	3.3915	2.0644	1.0026	1.0002
H4	1.0837	2.1281	2.7534		1.8464	3.0825	2.6161	3.7436
H5	1.0798	2.1055	3.3915	1.8464		2.4276	3.7703	4.1852
H6	2.1028	1.0852	2.0644	3.0825	2.4276		2.9735	2.3324
H7	2.7044	2.0784	1.0026	2.6161	3.7703	2.9735		1.7150
H8	3.3188	2.0808	1.0002	3.7436	4.1852	2.3324	1.7150

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	126.837	C1	C2	H6	119.774
C2	C1	H4	122.353	C2	C1	H5	120.469
C2	N3	H7	120.871	C2	N3	H8	121.311
N3	C2	H6	113.389	H4	C1	H5	117.177
H7	N3	H8	117.818

All results from a given calculation for CH₂CHNH₂ (aminoethene)

using model chemistry: B1B95/6-31G

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	-0.391
2	C	0.119
3	N	-0.793
4	H	0.121
5	H	0.134
6	H	0.151
7	H	0.330
8	H	0.330

	x	y	z	Total
	1.818	0.040	0.001	1.818
CHELPG
AIM
ESP

	x	y	z
x	6.222	0.476	-0.000
y	0.476	4.021	0.000
z	-0.000	0.000	1.437

<r²>	49.670
(<r²>)^1/2	7.048

All results from a given calculation for CH2CHNH2 (aminoethene)

using model chemistry: B1B95/6-31G

States and conformations

All results from a given calculation for CH₂CHNH₂ (aminoethene)