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	hartrees
Energy at 0K	-149.774016
Energy at 298.15K	-149.779270
Nuclear repulsion energy	71.321358

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3693	3642	28.10
2	A	3540	3491	23.18
3	A	3383	3336	3.99
4	A	2974	2933	84.32
5	A	1703	1680	260.86
6	A	1614	1591	27.20
7	A	1365	1346	45.65
8	A	1321	1303	25.25
9	A	1093	1078	97.71
10	A	1044	1030	49.30
11	A	1024	1010	0.04
12	A	787	776	40.47
13	A	599	590	257.86
14	A	531	524	22.67
15	A	348	344	178.65

Atom	x (Å)	y (Å)	z (Å)
C1	-0.116	0.406	0.000
N2	1.137	-0.157	-0.000
N3	-1.188	-0.331	-0.000
H4	-0.085	1.512	-0.000
H5	1.977	0.406	0.000
H6	1.211	-1.170	0.000
H7	-2.053	0.231	0.000

	C1	N2	N3	H4	H5	H6	H7
C1		1.3741	1.3004	1.1064	2.0937	2.0608	1.9448
N2	1.3741		2.3312	2.0690	1.0115	1.0159	3.2139
N3	1.3004	2.3312		2.1475	3.2497	2.5413	1.0322
H4	1.1064	2.0690	2.1475		2.3407	2.9793	2.3479
H5	2.0937	1.0115	3.2497	2.3407		1.7527	4.0344
H6	2.0608	1.0159	2.5413	2.9793	1.7527		3.5525
H7	1.9448	3.2139	1.0322	2.3479	4.0344	3.5525

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H5	121.979	C1	N2	H6	118.375
C1	N3	H7	112.465	N2	C1	N3	121.272
N2	C1	H4	112.603	N3	C1	H4	126.125
H5	N2	H6	119.646

All results from a given calculation for NHCHNH₂ (aminomethanimine)

using model chemistry: PBEPBE/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	0.170
2	N	-0.681
3	N	-0.518
4	H	0.126
5	H	0.320
6	H	0.328
7	H	0.254

	x	y	z	Total
	2.081	1.805	0.001	2.755
CHELPG
AIM
ESP

	x	y	z
x	5.718	0.214	0.000
y	0.214	3.722	0.000
z	0.000	0.000	1.349

<r²>	45.206
(<r²>)^1/2	6.724

All results from a given calculation for NHCHNH2 (aminomethanimine)

using model chemistry: PBEPBE/6-31G

States and conformations

All results from a given calculation for NHCHNH₂ (aminomethanimine)