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	hartrees
Energy at 0K	-133.949497
Energy at 298.15K	-133.954928
HF Energy	-133.949497
Nuclear repulsion energy	71.710175

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3708	3547	13.83
2	A	3602	3446	12.44
3	A	3268	3127	12.34
4	A	3179	3041	7.92
5	A	3167	3030	11.15
6	A	1737	1662	167.94
7	A	1659	1587	26.70
8	A	1452	1389	1.20
9	A	1341	1283	13.64
10	A	1301	1245	37.24
11	A	1089	1042	15.30
12	A	1011	967	25.45
13	A	965	924	2.37
14	A	816	781	78.09
15	A	715	684	13.51
16	A	586	561	277.14
17	A	469	449	3.13
18	A	359	343	56.11

Atom	x (Å)	y (Å)	z (Å)
C1	1.248	-0.195	0.016
C2	0.067	0.425	-0.001
N3	-1.182	-0.168	-0.084
H4	1.330	-1.276	0.022
H5	2.164	0.378	0.002
H6	0.029	1.510	-0.012
H7	-1.207	-1.152	0.132
H8	-1.932	0.338	0.356

	C1	C2	N3	H4	H5	H6	H7	H8
C1		1.3342	2.4319	1.0845	1.0803	2.0966	2.6376	3.2421
C2	1.3342		1.3843	2.1193	2.0978	1.0863	2.0314	2.0319
N3	2.4319	1.3843		2.7477	3.3909	2.0704	1.0078	1.0063
H4	1.0845	2.1193	2.7477		1.8522	3.0758	2.5429	3.6553
H5	1.0803	2.0978	3.3909	1.8522		2.4171	3.7042	4.1112
H6	2.0966	1.0863	2.0704	3.0758	2.4171		2.9388	2.3135
H7	2.6376	2.0314	1.0078	2.5429	3.7042	2.9388		1.6726
H8	3.2421	2.0319	1.0063	3.6553	4.1112	2.3135	1.6726

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	126.895	C1	C2	H6	119.687
C2	C1	H4	122.039	C2	C1	H5	120.287
C2	N3	H7	115.350	C2	N3	H8	115.508
N3	C2	H6	113.314	H4	C1	H5	117.659
H7	N3	H8	112.286

All results from a given calculation for CH₂CHNH₂ (aminoethene)

using model chemistry: mPW1PW91/6-311G**

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	-0.320
2	C	0.002
3	N	-0.444
4	H	0.103
5	H	0.117
6	H	0.115
7	H	0.212
8	H	0.215

	x	y	z	Total
	-1.355	-0.023	0.980	1.673
CHELPG
AIM
ESP

	x	y	z
x	6.612	-0.522	-0.031
y	-0.522	4.411	-0.000
z	-0.031	-0.000	2.583

<r²>	49.538
(<r²>)^1/2	7.038

All results from a given calculation for CH2CHNH2 (aminoethene)

using model chemistry: mPW1PW91/6-311G**

States and conformations

All results from a given calculation for CH₂CHNH₂ (aminoethene)