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	hartrees
Energy at 0K	-149.925836
Energy at 298.15K	-149.931217
HF Energy	-149.925836
Nuclear repulsion energy	72.150520

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3716	3519	32.99
2	A	3593	3402	28.51
3	A	3557	3368	1.31
4	A	3112	2947	55.39
5	A	1799	1704	275.59
6	A	1656	1568	42.96
7	A	1449	1372	25.59
8	A	1355	1283	25.56
9	A	1137	1077	111.27
10	A	1118	1058	8.95
11	A	1073	1017	4.48
12	A	824	781	28.77
13	A	599	567	281.70
14	A	561	531	26.15
15	A	420	398	144.13

Atom	x (Å)	y (Å)	z (Å)
C1	-0.125	0.394	-0.003
N2	1.138	-0.146	-0.076
N3	-1.167	-0.334	0.018
H4	-0.118	1.491	-0.014
H5	1.896	0.391	0.319
H6	1.174	-1.139	0.117
H7	-2.001	0.250	-0.000

	C1	N2	N3	H4	H5	H6	H7
C1		1.3752	1.2716	1.0969	2.0461	2.0133	1.8821
N2	1.3752		2.3145	2.0638	1.0093	1.0127	3.1649
N3	1.2716	2.3145		2.1054	3.1619	2.4777	1.0185
H4	1.0969	2.0638	2.1054		2.3186	2.9334	2.2558
H5	2.0461	1.0093	3.1619	2.3186		1.7040	3.9128
H6	2.0133	1.0127	2.4777	2.9334	1.7040		3.4679
H7	1.8821	3.1649	1.0185	2.2558	3.9128	3.4679

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H5	117.383	C1	N2	H6	114.075
C1	N3	H7	110.048	N2	C1	N3	121.904
N2	C1	H4	112.716	N3	C1	H4	125.316
H5	N2	H6	114.859

All results from a given calculation for NHCHNH₂ (aminomethanimine)

using model chemistry: M06-2X/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	0.215
2	N	-0.754
3	N	-0.608
4	H	0.143
5	H	0.345
6	H	0.355
7	H	0.303

	x	y	z	Total
	1.605	1.813	0.954	2.602
CHELPG
AIM
ESP

	x	y	z
x	5.351	0.245	0.036
y	0.245	3.559	-0.000
z	0.036	-0.000	1.672

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for NHCHNH2 (aminomethanimine)

using model chemistry: M06-2X/6-31G*

States and conformations

All results from a given calculation for NHCHNH₂ (aminomethanimine)