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	hartrees
Energy at 0K	-133.089432
Energy at 298.15K	-133.095019
HF Energy	-133.089432
Nuclear repulsion energy	71.816733

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3876	3529	18.96
2	A	3771	3434	16.14
3	A	3397	3094	16.21
4	A	3331	3033	8.20
5	A	3296	3001	7.74
6	A	1845	1680	194.47
7	A	1772	1614	25.33
8	A	1557	1418	1.86
9	A	1429	1302	6.52
10	A	1376	1253	52.22
11	A	1147	1044	16.02
12	A	1101	1002	27.62
13	A	1030	938	8.59
14	A	951	866	90.62
15	A	789	718	47.86
16	A	655	596	241.83
17	A	496	452	3.79
18	A	341	311	52.04

Atom	x (Å)	y (Å)	z (Å)
C1	1.243	-0.198	0.017
C2	0.072	0.427	-0.005
N3	-1.185	-0.166	-0.088
H4	1.318	-1.278	0.020
H5	2.160	0.369	0.014
H6	0.042	1.509	-0.014
H7	-1.204	-1.140	0.137
H8	-1.910	0.331	0.386

	C1	C2	N3	H4	H5	H6	H7	H8
C1		1.3282	2.4306	1.0823	1.0785	2.0883	2.6244	3.2181
C2	1.3282		1.3925	2.1124	2.0893	1.0824	2.0257	2.0220
N3	2.4306	1.3925		2.7409	3.3894	2.0780	0.9993	0.9983
H4	1.0823	2.1124	2.7409		1.8501	3.0660	2.5281	3.6249
H5	1.0785	2.0893	3.3894	1.8501		2.4062	3.6888	4.0870
H6	2.0883	1.0824	2.0780	3.0660	2.4062		2.9311	2.3143
H7	2.6244	2.0257	0.9993	2.5281	3.6888	2.9311		1.6502
H8	3.2181	2.0220	0.9983	3.6249	4.0870	2.3143	1.6502

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	126.584	C1	C2	H6	119.723
C2	C1	H4	122.080	C2	C1	H5	120.128
C2	N3	H7	114.761	C2	N3	H8	114.490
N3	C2	H6	113.609	H4	C1	H5	117.784
H7	N3	H8	111.400

All results from a given calculation for CH₂CHNH₂ (aminoethene)

using model chemistry: HF/aug-cc-pVDZ

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	0.610
2	C	0.728
3	N	-0.355
4	H	-0.320
5	H	-0.283
6	H	-0.325
7	H	-0.040
8	H	-0.014

	x	y	z	Total
	-1.048	0.017	1.037	1.474
CHELPG
AIM
ESP

	x	y	z
x	7.094	-0.583	0.027
y	-0.583	4.883	-0.012
z	0.027	-0.012	4.216

<r²>	49.829
(<r²>)^1/2	7.059

All results from a given calculation for CH2CHNH2 (aminoethene)

using model chemistry: HF/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₂CHNH₂ (aminoethene)