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	hartrees
Energy at 0K	-27.764121
Energy at 298.15K	-27.769428
Nuclear repulsion energy	40.596213

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3824	3661	38.07
2	A	3658	3503	39.18
3	A	3544	3393	7.28
4	A	3081	2950	83.19
5	A	1723	1650	359.61
6	A	1630	1561	26.54
7	A	1382	1323	48.17
8	A	1326	1270	31.90
9	A	1100	1053	132.11
10	A	1058	1013	0.51
11	A	1049	1005	33.24
12	A	800	766	65.45
13	A	605	579	317.51
14	A	518	496	26.78
15	A	395	378	170.92

Atom	x (Å)	y (Å)	z (Å)
C1	0.117	0.408	0.000
N2	-1.147	-0.158	-0.000
N3	1.195	-0.331	-0.000
H4	0.099	1.513	0.000
H5	-1.983	0.408	0.000
H6	-1.219	-1.168	0.000
H7	2.062	0.220	0.000

	C1	N2	N3	H4	H5	H6	H7
C1		1.3844	1.3068	1.1052	2.1002	2.0661	1.9536
N2	1.3844		2.3477	2.0840	1.0094	1.0131	3.2302
N3	1.3068	2.3477		2.1450	3.2625	2.5545	1.0270
H4	1.1052	2.0840	2.1450		2.3577	2.9876	2.3503
H5	2.1002	1.0094	3.2625	2.3577		1.7511	4.0490
H6	2.0661	1.0131	2.5545	2.9876	1.7511		3.5618
H7	1.9536	3.2302	1.0270	2.3503	4.0490	3.5618

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H5	121.850	C1	N2	H6	118.202
C1	N3	H7	113.127	N2	C1	N3	121.441
N2	C1	H4	113.190	N3	C1	H4	125.369
H5	N2	H6	119.948

All results from a given calculation for NHCHNH₂ (aminomethanimine)

using model chemistry: B1B95/CEP-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	-0.495
2	N	-0.379
3	N	-0.127
4	H	0.182
5	H	0.296
6	H	0.318
7	H	0.204

	x	y	z	Total
	-2.209	2.251	0.002	3.154
CHELPG
AIM
ESP

	x	y	z
x	5.581	-0.295	0.000
y	-0.295	3.446	0.000
z	0.000	0.000	1.793

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for NHCHNH2 (aminomethanimine)

using model chemistry: B1B95/CEP-31G

States and conformations

All results from a given calculation for NHCHNH₂ (aminomethanimine)