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	hartrees
Energy at 0K	-133.956204
Energy at 298.15K	-133.961623
HF Energy	-133.956204
Nuclear repulsion energy	71.806087

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3709	3548	20.38
2	A	3603	3446	14.82
3	A	3265	3124	10.43
4	A	3188	3050	6.73
5	A	3166	3029	7.92
6	A	1733	1658	192.58
7	A	1658	1586	23.67
8	A	1458	1394	2.18
9	A	1339	1281	7.60
10	A	1299	1242	51.85
11	A	1085	1038	18.65
12	A	1006	962	21.42
13	A	971	929	4.17
14	A	836	800	77.64
15	A	712	681	7.32
16	A	557	533	249.25
17	A	475	455	4.25
18	A	350	335	49.34

Atom	x (Å)	y (Å)	z (Å)
C1	1.243	-0.198	0.017
C2	0.072	0.430	-0.002
N3	-1.184	-0.167	-0.088
H4	1.317	-1.278	0.024
H5	2.164	0.364	0.005
H6	0.035	1.513	-0.019
H7	-1.199	-1.152	0.126
H8	-1.921	0.327	0.388

	C1	C2	N3	H4	H5	H6	H7	H8
C1		1.3291	2.4293	1.0832	1.0790	2.0949	2.6240	3.2284
C2	1.3291		1.3924	2.1140	2.0934	1.0841	2.0327	2.0329
N3	2.4293	1.3924		2.7388	3.3908	2.0762	1.0082	1.0067
H4	1.0832	2.1140	2.7388		1.8485	3.0722	2.5209	3.6320
H5	1.0790	2.0934	3.3908	1.8485		2.4195	3.6908	4.1028
H6	2.0949	1.0841	2.0762	3.0722	2.4195		2.9402	2.3231
H7	2.6240	2.0327	1.0082	2.5209	3.6908	2.9402		1.6664
H8	3.2284	2.0329	1.0067	3.6320	4.1028	2.3231	1.6664

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	126.396	C1	C2	H6	120.133
C2	C1	H4	122.077	C2	C1	H5	120.409
C2	N3	H7	114.776	C2	N3	H8	114.898
N3	C2	H6	113.348	H4	C1	H5	117.501
H7	N3	H8	111.596

All results from a given calculation for CH₂CHNH₂ (aminoethene)

using model chemistry: wB97X-D/aug-cc-pVTZ

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	-0.957
2	C	-0.121
3	N	-0.327
4	H	0.414
5	H	0.320
6	H	0.543
7	H	0.058
8	H	0.072

	x	y	z	Total
	-1.275	-0.023	0.886	1.552
CHELPG
AIM
ESP

	x	y	z
x	7.546	-0.399	0.064
y	-0.399	5.143	-0.013
z	0.064	-0.013	4.437

<r²>	49.653
(<r²>)^1/2	7.047

All results from a given calculation for CH2CHNH2 (aminoethene)

using model chemistry: wB97X-D/aug-cc-pVTZ

States and conformations

All results from a given calculation for CH₂CHNH₂ (aminoethene)