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	hartrees
Energy at 0K	-94.595101
Energy at 298.15K	-94.598017
HF Energy	-94.595101
Nuclear repulsion energy	32.766007

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'	3540	3410	6.90	93.70	0.60	0.75
2	A'	3346	3223	41.52	352.79	0.31	0.47
3	A'	2898	2791	145.11	167.92	0.52	0.68
4	A'	1744	1680	7.32	26.80	0.45	0.62
5	A'	1441	1388	23.90	8.79	0.63	0.77
6	A'	1402	1350	8.56	1.53	0.05	0.10
7	A'	1082	1042	27.41	12.32	0.52	0.69
8	A"	1173	1129	12.36	1.06	0.75	0.86
9	A"	814	784	189.61	1.01	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.791
N2	0.063	-0.524
H3	-1.009	1.086
H4	-0.752	-1.143
H5	0.946	-1.021

	C1	N2	H3	H4	H5
C1		1.3148	1.1118	2.0988	2.0162
N2	1.3148		1.9340	1.0236	1.0139
H3	1.1118	1.9340		2.2438	2.8748
H4	2.0988	1.0236	2.2438		1.7028
H5	2.0162	1.0139	2.8748	1.7028

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.225		C1	N2	H5	119.395
N2	C1	H3	105.386		H4	N2	H5	113.380

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: TPSSh/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	-0.205
2	N	-0.599
3	H	0.143
4	H	0.313
5	H	0.349

	x	y	z	Total
	-1.276	-3.267	0.000	3.508
CHELPG
AIM
ESP

	x	y	z
x	2.961	-0.132	0.000
y	-0.132	3.995	0.000
z	0.000	0.000	1.716

<r²>	19.834
(<r²>)^1/2	4.454

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: TPSSh/6-311G*

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)