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	hartrees
Energy at 0K	-94.552674
Energy at 298.15K	-94.555571
HF Energy	-94.552674
Nuclear repulsion energy	32.765679

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'	3461	3413	8.54	102.60	0.58	0.73
2	A'	3255	3210	60.54	468.33	0.30	0.46
3	A'	2837	2797	127.81	177.55	0.53	0.69
4	A'	1653	1630	4.94	33.06	0.43	0.60
5	A'	1405	1385	13.88	7.98	0.42	0.59
6	A'	1350	1331	9.31	1.13	0.75	0.86
7	A'	1052	1037	29.02	16.36	0.41	0.58
8	A"	1141	1125	11.44	1.39	0.75	0.86
9	A"	782	771	136.72	0.94	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.789
N2	0.063	-0.524
H3	-1.009	1.094
H4	-0.755	-1.143
H5	0.947	-1.022

	C1	N2	H3	H4	H5
C1		1.3128	1.1141	2.0979	2.0159
N2	1.3128		1.9405	1.0257	1.0153
H3	1.1141	1.9405		2.2514	2.8819
H4	2.0979	1.0257	2.2514		1.7063
H5	2.0159	1.0153	2.8819	1.7063

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.133		C1	N2	H5	119.421
N2	C1	H3	105.890		H4	N2	H5	113.446

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: B97D3/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	-0.287
2	N	-0.076
3	H	0.057
4	H	0.135
5	H	0.171

	x	y	z	Total
	-1.212	-3.195	0.000	3.417
CHELPG
AIM
ESP

	x	y	z
x	3.397	-0.030	0.000
y	-0.030	4.462	0.000
z	0.000	0.000	2.183

<r²>	19.926
(<r²>)^1/2	4.464

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: B97D3/cc-pVTZ

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)