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	hartrees
Energy at 0K	-17.268139
Energy at 298.15K	-17.271014
HF Energy	-17.268139
Nuclear repulsion energy	19.046772

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'	3562	3440	11.20	84.48	0.60	0.75
2	A'	3387	3271	15.86	278.31	0.26	0.41
3	A'	2916	2816	145.60	127.91	0.49	0.66
4	A'	1685	1627	13.57	23.10	0.38	0.55
5	A'	1400	1352	33.56	12.42	0.68	0.81
6	A'	1379	1331	19.68	3.23	0.24	0.39
7	A'	1038	1002	29.67	14.22	0.66	0.79
8	A"	1132	1093	16.65	0.19	0.75	0.86
9	A"	754	728	206.23	0.27	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.805
N2	0.063	-0.534
H3	-1.022	1.094
H4	-0.754	-1.164
H5	0.962	-1.022

	C1	N2	H3	H4	H5
C1		1.3393	1.1227	2.1321	2.0365
N2	1.3393		1.9561	1.0315	1.0230
H3	1.1227	1.9561		2.2738	2.9004
H4	2.1321	1.0315	2.2738		1.7215
H5	2.0365	1.0230	2.9004	1.7215

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.668		C1	N2	H5	118.490
N2	C1	H3	104.879		H4	N2	H5	113.843

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: B3LYP/CEP-31G*

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	-0.431
2	N	-0.305
3	H	0.121
4	H	0.290
5	H	0.325

	x	y	z	Total
	-1.436	-3.277	0.000	3.578
CHELPG
AIM
ESP

	x	y	z
x	2.718	-0.109	0.000
y	-0.109	4.014	0.000
z	0.000	0.000	1.823

<r²>	18.255
(<r²>)^1/2	4.273

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: B3LYP/CEP-31G*

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)