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	hartrees
Energy at 0K	-94.026851
Energy at 298.15K	-94.029793
HF Energy	-94.026851
Nuclear repulsion energy	33.244685

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'	3841	3489	37.81	59.97	0.71	0.83
2	A'	3721	3380	3.88	158.11	0.14	0.25
3	A'	3094	2811	103.94	146.96	0.39	0.56
4	A'	1833	1665	44.83	6.75	0.69	0.82
5	A'	1506	1368	15.71	0.96	0.75	0.86
6	A'	1498	1361	45.01	12.54	0.10	0.18
7	A'	1153	1048	20.61	3.44	0.20	0.33
8	A"	1209	1098	11.44	0.15	0.75	0.86
9	A"	822	747	185.43	0.07	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.062	0.778
N2	0.062	-0.523
H3	-0.982	1.102
H4	-0.754	-1.095
H5	0.925	-1.015

	C1	N2	H3	H4	H5
C1		1.3005	1.0934	2.0429	1.9897
N2	1.3005		1.9316	0.9972	0.9936
H3	1.0934	1.9316		2.2090	2.8497
H4	2.0429	0.9972	2.2090		1.6817
H5	1.9897	0.9936	2.8497	1.6817

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	125.012		C1	N2	H5	119.701
N2	C1	H3	107.275		H4	N2	H5	115.287

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: HF/aug-cc-pVQZ

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	-0.335
2	N	-0.550
3	H	0.256
4	H	0.293
5	H	0.335

	x	y	z	Total
	-1.460	-3.053	0.000	3.384
CHELPG
AIM
ESP

	x	y	z
x	3.381	-0.028	0.000
y	-0.028	4.137	0.000
z	0.000	0.000	2.794

<r²>	19.715
(<r²>)^1/2	4.440

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: HF/aug-cc-pVQZ

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)