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	hartrees
Energy at 0K	-94.476003
Energy at 298.15K	-94.478903
HF Energy	-94.476003
Nuclear repulsion energy	32.628689

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'	3437	3405	7.82	105.62	0.57	0.73
2	A'	3209	3179	74.49	506.70	0.32	0.49
3	A'	2816	2791	127.27	181.31	0.55	0.71
4	A'	1643	1629	3.94	35.86	0.41	0.58
5	A'	1414	1401	7.84	7.66	0.56	0.71
6	A'	1343	1331	15.77	2.39	0.74	0.85
7	A'	1041	1032	33.09	20.20	0.47	0.64
8	A"	1139	1129	12.67	1.15	0.75	0.86
9	A"	801	794	155.08	1.62	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.792
N2	0.063	-0.524
H3	-1.018	1.091
H4	-0.756	-1.156
H5	0.955	-1.023

	C1	N2	H3	H4	H5
C1		1.3160	1.1211	2.1134	2.0227
N2	1.3160		1.9428	1.0344	1.0224
H3	1.1211	1.9428		2.2622	2.8915
H4	2.1134	1.0344	2.2622		1.7159
H5	2.0227	1.0224	2.8915	1.7159

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.689		C1	N2	H5	119.236
N2	C1	H3	105.446		H4	N2	H5	113.075

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: PBEPBE/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	-0.195
2	N	-0.309
3	H	0.078
4	H	0.192
5	H	0.234

	x	y	z	Total
	-1.194	-3.219	0.000	3.433
CHELPG
AIM
ESP

	x	y	z
x	3.127	-0.078	0.000
y	-0.078	4.271	0.000
z	0.000	0.000	1.811

<r²>	19.972
(<r²>)^1/2	4.469

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: PBEPBE/6-311G**

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)