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	hartrees
Energy at 0K	-94.016097
Energy at 298.15K	-94.019046
HF Energy	-94.016097
Nuclear repulsion energy	33.189124

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'	3842	3491	34.16	69.20	0.70	0.82
2	A'	3719	3379	4.32	150.49	0.18	0.31
3	A'	3104	2820	117.84	156.45	0.45	0.62
4	A'	1845	1677	42.94	10.05	0.58	0.73
5	A'	1520	1381	21.05	3.21	0.57	0.72
6	A'	1502	1365	46.96	7.98	0.32	0.49
7	A'	1161	1055	18.99	3.27	0.64	0.78
8	A"	1217	1105	10.41	2.18	0.75	0.86
9	A"	840	763	219.94	0.13	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.062	0.780
N2	0.062	-0.523
H3	-0.985	1.098
H4	-0.753	-1.101
H5	0.928	-1.015

	C1	N2	H3	H4	H5
C1		1.3026	1.0947	2.0497	1.9924
N2	1.3026		1.9299	0.9996	0.9958
H3	1.0947	1.9299		2.2108	2.8503
H4	2.0497	0.9996	2.2108		1.6839
H5	1.9924	0.9958	2.8503	1.6839

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	125.307		C1	N2	H5	119.589
N2	C1	H3	106.903		H4	N2	H5	115.104

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: HF/TZVP

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	-0.094
2	N	-0.383
3	H	0.012
4	H	0.214
5	H	0.250

	x	y	z	Total
	-1.519	-3.082	0.000	3.436
CHELPG
AIM
ESP

	x	y	z
x	2.936	-0.168	0.000
y	-0.168	3.765	0.000
z	0.000	0.000	2.065

<r²>	19.718
(<r²>)^1/2	4.440

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: HF/TZVP

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)