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	hartrees
Energy at 0K	-94.563965
Energy at 298.15K	-94.566886
HF Energy	-94.563965
Nuclear repulsion energy	32.968438

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'	3590	3429	26.34	83.13	0.64	0.78
2	A'	3449	3294	1.53	222.33	0.22	0.36
3	A'	2960	2827	97.04	144.55	0.44	0.61
4	A'	1689	1613	21.95	14.65	0.51	0.67
5	A'	1458	1393	16.06	9.84	0.27	0.42
6	A'	1399	1336	16.29	1.86	0.75	0.86
7	A'	1079	1030	20.98	5.87	0.45	0.62
8	A"	1165	1113	12.77	1.16	0.75	0.86
9	A"	820	783	155.48	0.41	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.784
N2	0.063	-0.522
H3	-1.000	1.087
H4	-0.757	-1.122
H5	0.943	-1.018

	C1	N2	H3	H4	H5
C1		1.3058	1.1050	2.0756	2.0062
N2	1.3058		1.9278	1.0167	1.0109
H3	1.1050	1.9278		2.2225	2.8649
H4	2.0756	1.0167	2.2225		1.7037
H5	2.0062	1.0109	2.8649	1.7037

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	126.228		C1	N2	H5	119.438
N2	C1	H3	105.890		H4	N2	H5	114.334

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: M06-2X/cc-pVTZ

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	-0.271
2	N	-0.202
3	H	0.071
4	H	0.192
5	H	0.210

	x	y	z	Total
	-1.308	-3.193	0.000	3.451
CHELPG
AIM
ESP

	x	y	z
x	3.196	-0.134	0.000
y	-0.134	4.104	0.000
z	0.000	0.000	2.153

<r²>	19.780
(<r²>)^1/2	4.447

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: M06-2X/cc-pVTZ

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)