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	hartrees
Energy at 0K	-148.237766
Energy at 298.15K	-148.243166
Nuclear repulsion energy	72.629888

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3920	3550	51.60
2	A'	3787	3429	44.86
3	A'	3657	3311	0.77
4	A'	3234	2929	59.46
5	A'	1874	1697	293.74
6	A'	1794	1625	40.18
7	A'	1543	1397	66.19
8	A'	1435	1299	49.21
9	A'	1181	1069	114.13
10	A'	1146	1038	101.99
11	A'	584	529	21.02
12	A"	1222	1107	7.72
13	A"	892	808	41.72
14	A"	623	564	306.46
15	A"	343	311	218.91

Atom	x (Å)	y (Å)
C1	0.000	0.410
N2	-1.028	-0.488
N3	1.208	0.053
H4	-0.344	1.434
H5	-1.979	-0.202
H6	-0.810	-1.460
H7	1.872	0.812

	C1	N2	N3	H4	H5	H6	H7
C1		1.3645	1.2597	1.0806	2.0716	2.0381	1.9151
N2	1.3645		2.3005	2.0397	0.9933	0.9967	3.1782
N3	1.2597	2.3005		2.0778	3.1976	2.5227	1.0085
H4	1.0806	2.0397	2.0778		2.3130	2.9317	2.3024
H5	2.0716	0.9933	3.1976	2.3130		1.7175	3.9829
H6	2.0381	0.9967	2.5227	2.9317	1.7175		3.5156
H7	1.9151	3.1782	1.0085	2.3024	3.9829	3.5156

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H5	122.165	C1	N2	H6	118.509
C1	N3	H7	114.751	N2	C1	N3	122.427
N2	C1	H4	112.543	N3	C1	H4	125.030
H5	N2	H6	119.326

All results from a given calculation for NHCHNH₂ (aminomethanimine)

using model chemistry: HF/3-21G

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	0.441
2	N	-0.905
3	N	-0.715
4	H	0.203
5	H	0.342
6	H	0.358
7	H	0.276

	x	y	z	Total
	-2.369	1.542	0.000	2.827
CHELPG
AIM
ESP

	x	y	z
x	4.799	0.249	0.000
y	0.249	2.887	0.000
z	0.000	0.000	0.951

<r²>	44.151
(<r²>)^1/2	6.645

All results from a given calculation for NHCHNH2 (aminomethanimine)

using model chemistry: HF/3-21G

States and conformations

All results from a given calculation for NHCHNH₂ (aminomethanimine)