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	hartrees
Energy at 0K	-149.866200
Energy at 298.15K	-149.871480
Nuclear repulsion energy	71.716299

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3616	3583	21.69
2	A	3485	3453	12.51
3	A	3432	3401	0.87
4	A	2941	2914	77.91
5	A	1691	1675	244.07
6	A	1569	1555	31.92
7	A	1363	1351	28.34
8	A	1299	1287	19.86
9	A	1084	1075	113.06
10	A	1063	1054	8.14
11	A	1002	992	0.33
12	A	778	771	36.25
13	A	574	569	153.17
14	A	529	524	36.37
15	A	384	381	151.65

Atom	x (Å)	y (Å)	z (Å)
C1	-0.123	0.397	-0.001
N2	1.141	-0.149	-0.069
N3	-1.177	-0.335	0.016
H4	-0.103	1.504	-0.012
H5	1.917	0.399	0.285
H6	1.187	-1.151	0.109
H7	-2.012	0.259	-0.005

	C1	N2	N3	H4	H5	H6	H7
C1		1.3778	1.2836	1.1070	2.0592	2.0304	1.8940
N2	1.3778		2.3264	2.0691	1.0141	1.0181	3.1791
N3	1.2836	2.3264		2.1296	3.1908	2.5027	1.0249
H4	1.1070	2.0691	2.1296		2.3208	2.9536	2.2785
H5	2.0592	1.0141	3.1908	2.3208		1.7215	3.9413
H6	2.0304	1.0181	2.5027	2.9536	1.7215		3.4977
H7	1.8940	3.1791	1.0249	2.2785	3.9413	3.4977

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H5	118.038	C1	N2	H6	115.052
C1	N3	H7	109.747	N2	C1	N3	121.845
N2	C1	H4	112.302	N3	C1	H4	125.797
H5	N2	H6	115.800

All results from a given calculation for NHCHNH₂ (aminomethanimine)

using model chemistry: PBEPBE/6-311G**

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	0.098
2	N	-0.390
3	N	-0.385
4	H	0.080
5	H	0.214
6	H	0.215
7	H	0.168

	x	y	z	Total
	1.808	1.638	0.743	2.550
CHELPG
AIM
ESP

	x	y	z
x	5.854	0.176	0.043
y	0.176	4.101	-0.015
z	0.043	-0.015	2.233

<r²>	44.867
(<r²>)^1/2	6.698

All results from a given calculation for NHCHNH2 (aminomethanimine)

using model chemistry: PBEPBE/6-311G**

States and conformations

All results from a given calculation for NHCHNH₂ (aminomethanimine)