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	hartrees
Energy at 0K	-149.964589
Energy at 298.15K	-149.969810
Nuclear repulsion energy	72.099663

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3758	3608	46.15
2	A	3615	3471	33.20
3	A	3562	3420	6.73
4	A	3065	2943	60.72
5	A	1746	1677	356.07
6	A	1625	1560	35.24
7	A	1412	1356	22.29
8	A	1336	1282	34.64
9	A	1115	1070	118.86
10	A	1086	1043	8.23
11	A	1043	1001	0.09
12	A	798	766	62.74
13	A	565	542	75.07
14	A	529	508	66.02
15	A	319	306	218.98

Atom	x (Å)	y (Å)	z (Å)
C1	-0.121	0.393	-0.001
N2	1.133	-0.149	-0.053
N3	-1.174	-0.332	0.011
H4	-0.113	1.491	-0.007
H5	1.926	0.412	0.210
H6	1.206	-1.146	0.090
H7	-2.007	0.252	0.001

	C1	N2	N3	H4	H5	H6	H7
C1		1.3669	1.2785	1.0982	2.0578	2.0339	1.8912
N2	1.3669		2.3153	2.0599	1.0061	1.0100	3.1658
N3	1.2785	2.3153		2.1093	3.1942	2.5169	1.0169
H4	1.0982	2.0599	2.1093		2.3169	2.9499	2.2633
H5	2.0578	1.0061	3.1942	2.3169		1.7202	3.9416
H6	2.0339	1.0100	2.5169	2.9499	1.7202		3.5050
H7	1.8912	3.1658	1.0169	2.2633	3.9416	3.5050

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	H5	119.484	C1	N2	H6	116.882
C1	N3	H7	110.434	N2	C1	N3	122.110
N2	C1	H4	112.907	N3	C1	H4	124.950
H5	N2	H6	117.127

All results from a given calculation for NHCHNH₂ (aminomethanimine)

using model chemistry: B3PW91/6-31+G**

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	0.023
2	N	-0.502
3	N	-0.534
4	H	0.131
5	H	0.302
6	H	0.321
7	H	0.259

	x	y	z	Total
	1.992	1.990	0.634	2.886
CHELPG
AIM
ESP

	x	y	z
x	6.071	0.413	-0.054
y	0.413	4.250	-0.012
z	-0.054	-0.012	3.023

<r²>	0.000
(<r²>)^1/2	0.000

All results from a given calculation for NHCHNH2 (aminomethanimine)

using model chemistry: B3PW91/6-31+G**

States and conformations

All results from a given calculation for NHCHNH₂ (aminomethanimine)