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	hartrees
Energy at 0K	-94.535337
Energy at 298.15K	-94.538238
HF Energy	-94.535337
Nuclear repulsion energy	32.665923

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A'	3465	3465	3.91	100.33	0.58	0.73
2	A'	3230	3230	85.87	481.74	0.33	0.49
3	A'	2819	2819	157.03	181.30	0.56	0.72
4	A'	1708	1708	3.55	35.78	0.43	0.60
5	A'	1416	1416	19.92	8.20	0.66	0.79
6	A'	1363	1363	7.92	1.45	0.52	0.69
7	A'	1069	1069	31.98	19.25	0.49	0.66
8	A"	1148	1148	12.30	1.11	0.75	0.86
9	A"	792	792	181.01	1.54	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.793
N2	0.063	-0.524
H3	-1.016	1.087
H4	-0.752	-1.153
H5	0.949	-1.023

	C1	N2	H3	H4	H5
C1		1.3174	1.1183	2.1098	2.0210
N2	1.3174		1.9390	1.0292	1.0170
H3	1.1183	1.9390		2.2551	2.8834
H4	2.1098	1.0292	2.2551		1.7061
H5	2.0210	1.0170	2.8834	1.7061

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.644		C1	N2	H5	119.377
N2	C1	H3	105.221		H4	N2	H5	112.979

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: B97D3/6-311G*

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	-0.211
2	N	-0.577
3	H	0.141
4	H	0.303
5	H	0.344

	x	y	z	Total
	-1.208	-3.220	0.000	3.439
CHELPG
AIM
ESP

	x	y	z
x	3.046	-0.087	0.000
y	-0.087	4.168	0.000
z	0.000	0.000	1.727

<r²>	19.918
(<r²>)^1/2	4.463

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: B97D3/6-311G*

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)