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	hartrees
Energy at 0K	-94.558799
Energy at 298.15K	-94.561695
HF Energy	-94.558799
Nuclear repulsion energy	32.563034

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'	3417	3408	3.83	103.15	0.57	0.72
2	A'	3169	3161	104.92	541.75	0.33	0.50
3	A'	2799	2792	149.34	188.90	0.58	0.74
4	A'	1690	1686	3.04	38.95	0.42	0.59
5	A'	1406	1402	18.70	8.13	0.65	0.79
6	A'	1349	1345	6.42	2.44	0.74	0.85
7	A'	1059	1056	34.45	23.29	0.47	0.64
8	A"	1140	1137	12.92	1.11	0.75	0.86
9	A"	789	787	174.08	2.14	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.795
N2	0.063	-0.525
H3	-1.016	1.094
H4	-0.756	-1.159
H5	0.953	-1.027

	C1	N2	H3	H4	H5
C1		1.3203	1.1195	2.1189	2.0282
N2	1.3203		1.9459	1.0357	1.0221
H3	1.1195	1.9459		2.2683	2.8945
H4	2.1189	1.0357	2.2683		1.7143
H5	2.0282	1.0221	2.8945	1.7143

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.746		C1	N2	H5	119.416
N2	C1	H3	105.497		H4	N2	H5	112.838

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: BLYP/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	-0.208
2	N	-0.557
3	H	0.136
4	H	0.293
5	H	0.336

	x	y	z	Total
	-1.190	-3.204	0.000	3.418
CHELPG
AIM
ESP

	x	y	z
x	3.088	-0.063	0.000
y	-0.063	4.264	0.000
z	0.000	0.000	1.719

<r²>	20.085
(<r²>)^1/2	4.482

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: BLYP/6-311G*

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)