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	hartrees
Energy at 0K	-94.482739
Energy at 298.15K	-94.485662
HF Energy	-94.482739
Nuclear repulsion energy	32.914778

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'	3593	3448	10.24	91.78	0.62	0.77
2	A'	3417	3279	26.45	312.30	0.30	0.46
3	A'	2931	2813	130.11	161.98	0.50	0.67
4	A'	1748	1678	10.74	24.17	0.45	0.62
5	A'	1467	1408	12.41	7.05	0.45	0.62
6	A'	1414	1357	19.94	3.25	0.58	0.74
7	A'	1096	1051	26.83	10.37	0.54	0.70
8	A"	1175	1127	12.94	0.99	0.75	0.86
9	A"	824	791	194.27	0.94	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.786
N2	0.063	-0.521
H3	-1.007	1.084
H4	-0.752	-1.134
H5	0.943	-1.018

	C1	N2	H3	H4	H5
C1		1.3071	1.1107	2.0860	2.0076
N2	1.3071		1.9293	1.0198	1.0112
H3	1.1107	1.9293		2.2335	2.8680
H4	2.0860	1.0198	2.2335		1.6994
H5	2.0076	1.0112	2.8680	1.6994

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	126.969		C1	N2	H5	119.441
N2	C1	H3	105.592		H4	N2	H5	113.590

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: HSEh1PBE/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	-0.218
2	N	-0.623
3	H	0.156
4	H	0.326
5	H	0.360

	x	y	z	Total
	-1.311	-3.267	0.000	3.521
CHELPG
AIM
ESP

	x	y	z
x	2.896	-0.148	0.000
y	-0.148	3.898	0.000
z	0.000	0.000	1.715

<r²>	19.725
(<r²>)^1/2	4.441

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: HSEh1PBE/6-311G*

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)