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	hartrees
Energy at 0K	-148.032969
Energy at 298.15K	-148.038172
Nuclear repulsion energy	69.720902

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3786	3379	0.28
2	A	3584	3198	4.46
3	A	3476	3102	13.15
4	A	3324	2967	2.04
5	A	1806	1611	70.46
6	A	1739	1552	27.38
7	A	1472	1313	21.17
8	A	1393	1243	4.21
9	A	1197	1068	46.30
10	A	1134	1012	10.12
11	A	1073	958	0.36
12	A	800	714	14.53
13	A	692	618	302.72
14	A	534	476	4.37
15	A	403	360	82.68

Atom	x (Å)	y (Å)	z (Å)
C1	-0.134	0.423	-0.000
N2	1.181	-0.148	-0.110
N3	-1.194	-0.362	0.023
H4	-0.114	1.534	-0.025
H5	1.884	0.361	0.479
H6	1.162	-1.162	0.162
H7	-2.037	0.302	-0.005

	C1	N2	N3	H4	H5	H6	H7
C1		1.4378	1.3190	1.1113	2.0756	2.0543	1.9068
N2	1.4378		2.3876	2.1243	1.0502	1.0502	3.2507
N3	1.3190	2.3876		2.1826	3.1947	2.4918	1.0736
H4	1.1113	2.1243	2.1826		2.3710	2.9888	2.2843
H5	2.0756	1.0502	3.1947	2.3710		1.7158	3.9517
H6	2.0543	1.0502	2.4918	2.9888	1.7158		3.5222
H7	1.9068	3.2507	1.0736	2.2843	3.9517	3.5222

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H5	112.141	C1	N2	H6	110.349
C1	N3	H7	105.214	N2	C1	N3	119.952
N2	C1	H4	112.261	N3	C1	H4	127.606
H5	N2	H6	109.552

All results from a given calculation for NHCHNH₂ (aminomethanimine)

using model chemistry: B3LYP/STO-3G

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	0.084
2	N	-0.363
3	N	-0.317
4	H	0.071
5	H	0.185
6	H	0.196
7	H	0.143

	x	y	z	Total
	1.082	1.494	1.230	2.217
CHELPG
AIM
ESP

	x	y	z
x	3.924	0.063	0.124
y	0.063	2.059	0.032
z	0.124	0.032	0.609

<r²>	45.629
(<r²>)^1/2	6.755

All results from a given calculation for NHCHNH2 (aminomethanimine)

using model chemistry: B3LYP/STO-3G

States and conformations

All results from a given calculation for NHCHNH₂ (aminomethanimine)