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	hartrees
Energy at 0K	-147.370747
Energy at 298.15K	-147.375940
HF Energy	-147.143663
Nuclear repulsion energy	68.794997

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3674	3674	8.12
2	A	3489	3489	8.63
3	A	3443	3443	23.69
4	A	3338	3338	1.04
5	A	1839	1839	9.89
6	A	1730	1730	29.05
7	A	1501	1501	12.76
8	A	1406	1406	0.94
9	A	1238	1238	31.94
10	A	1167	1167	12.92
11	A	1086	1086	3.47
12	A	958	958	116.37
13	A	741	741	64.53
14	A	510	510	8.53
15	A	326	326	64.38

Atom	x (Å)	y (Å)	z (Å)
C1	-0.142	0.436	-0.008
N2	1.219	-0.137	-0.132
N3	-1.196	-0.374	0.026
H4	-0.158	1.553	-0.036
H5	1.793	0.291	0.658
H6	1.114	-1.158	0.154
H7	-2.058	0.279	0.011

	C1	N2	N3	H4	H5	H6	H7
C1		1.4814	1.3300	1.1171	2.0511	2.0357	1.9232
N2	1.4814		2.4315	2.1820	1.0661	1.0652	3.3065
N3	1.3300	2.4315		2.1891	3.1267	2.4430	1.0815
H4	1.1171	2.1820	2.1891		2.4251	3.0005	2.2880
H5	2.0511	1.0661	3.1267	2.4251		1.6778	3.9053
H6	2.0357	1.0652	2.4430	3.0005	1.6778		3.4856
H7	1.9232	3.3065	1.0815	2.2880	3.9053	3.4856

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H5	106.094	C1	N2	H6	104.962
C1	N3	H7	105.321	N2	C1	N3	119.639
N2	C1	H4	113.474	N3	C1	H4	126.691
H5	N2	H6	103.852

All results from a given calculation for NHCHNH₂ (aminomethanimine)

using model chemistry: QCISD/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	0.132
2	N	-0.350
3	N	-0.296
4	H	0.066
5	H	0.152
6	H	0.167
7	H	0.129

	x	y	z
x	0.000	0.000	0.000
y	0.000	0.000	0.000
z	0.000	0.000	0.000

<r²>	46.679
(<r²>)^1/2	6.832

All results from a given calculation for NHCHNH2 (aminomethanimine)

using model chemistry: QCISD/STO-3G

States and conformations

All results from a given calculation for NHCHNH₂ (aminomethanimine)