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	hartrees
Energy at 0K	-133.942723
Energy at 298.15K	-133.948163
HF Energy	-133.942723
Nuclear repulsion energy	71.327401

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3629	3485	4.80
2	A	3530	3390	4.67
3	A	3258	3129	16.55
4	A	3176	3050	8.82
5	A	3166	3041	14.44
6	A	1742	1673	127.89
7	A	1682	1615	24.35
8	A	1474	1415	1.86
9	A	1351	1297	7.74
10	A	1304	1252	30.56
11	A	1090	1047	10.78
12	A	1008	968	20.32
13	A	969	930	2.21
14	A	809	777	70.13
15	A	738	709	95.63
16	A	635	610	220.77
17	A	470	452	4.12
18	A	356	342	54.58

Atom	x (Å)	y (Å)	z (Å)
C1	1.252	-0.197	0.019
C2	0.069	0.430	-0.002
N3	-1.191	-0.167	-0.092
H4	1.333	-1.281	0.028
H5	2.176	0.370	-0.003
H6	0.026	1.518	-0.017
H7	-1.199	-1.157	0.128
H8	-1.925	0.320	0.409

	C1	C2	N3	H4	H5	H6	H7	H8
C1		1.3391	2.4462	1.0877	1.0837	2.1081	2.6351	3.2424
C2	1.3391		1.3973	2.1274	2.1079	1.0889	2.0356	2.0386
N3	2.4462	1.3973		2.7616	3.4109	2.0799	1.0145	1.0133
H4	1.0877	2.1274	2.7616		1.8541	3.0894	2.5369	3.6497
H5	1.0837	2.1079	3.4109	1.8541		2.4374	3.7068	4.1217
H6	2.1081	1.0889	2.0799	3.0894	2.4374		2.9458	2.3286
H7	2.6351	2.0356	1.0145	2.5369	3.7068	2.9458		1.6694
H8	3.2424	2.0386	1.0133	3.6497	4.1217	2.3286	1.6694

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N3	126.735	C1	C2	H6	120.164
C2	C1	H4	122.145	C2	C1	H5	120.563
C2	N3	H7	114.199	C2	N3	H8	114.559
N3	C2	H6	112.974	H4	C1	H5	117.270
H7	N3	H8	110.832

All results from a given calculation for CH₂CHNH₂ (aminoethene)

using model chemistry: B3LYP/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	-0.381
2	C	0.081
3	N	-0.717
4	H	0.118
5	H	0.132
6	H	0.134
7	H	0.316
8	H	0.317

	x	y	z	Total
	-1.145	-0.062	1.137	1.615
CHELPG
AIM
ESP

	x	y	z
x	6.310	-0.459	-0.067
y	-0.459	4.223	0.007
z	-0.067	0.007	1.845

<r²>	49.819
(<r²>)^1/2	7.058

All results from a given calculation for CH2CHNH2 (aminoethene)

using model chemistry: B3LYP/6-31G*

States and conformations

All results from a given calculation for CH₂CHNH₂ (aminoethene)