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	hartrees
Energy at 0K	-94.529218
Energy at 298.15K	-94.532137
HF Energy	-94.529218
Nuclear repulsion energy	32.889618

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'	3605	3433	19.95	92.32	0.63	0.77
2	A'	3466	3301	1.19	208.49	0.22	0.36
3	A'	2947	2807	110.93	118.42	0.42	0.59
4	A'	1689	1609	17.21	18.05	0.47	0.64
5	A'	1463	1393	16.02	10.78	0.30	0.46
6	A'	1405	1339	15.89	6.18	0.69	0.82
7	A'	1072	1021	19.18	6.10	0.55	0.71
8	A"	1166	1111	9.69	1.12	0.75	0.86
9	A"	825	785	150.22	0.74	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.788
N2	0.063	-0.522
H3	-1.010	1.077
H4	-0.750	-1.133
H5	0.945	-1.018

	C1	N2	H3	H4	H5
C1		1.3097	1.1114	2.0857	2.0095
N2	1.3097		1.9256	1.0170	1.0119
H3	1.1114	1.9256		2.2251	2.8654
H4	2.0857	1.0170	2.2251		1.6990
H5	2.0095	1.0119	2.8654	1.6990

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	126.926		C1	N2	H5	119.344
N2	C1	H3	105.078		H4	N2	H5	113.730

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: M06-2X/6-31G(2df,p)

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	-0.275
2	N	-0.378
3	H	0.091
4	H	0.272
5	H	0.290

	x	y	z	Total
	-1.126	-3.200	0.000	3.392
CHELPG
AIM
ESP

	x	y	z
x	2.857	-0.283	0.000
y	-0.283	3.717	0.000
z	0.000	0.000	1.737

<r²>	19.590
(<r²>)^1/2	4.426

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: M06-2X/6-31G(2df,p)

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)