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	hartrees
Energy at 0K	-94.515937
Energy at 298.15K	-94.512009
HF Energy	-94.579296
Nuclear repulsion energy	32.808590

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'	3542	3418	9.69	97.65	0.56	0.71
2	A'	3380	3262	19.37	272.68	0.27	0.42
3	A'	2900	2799	111.52	122.05	0.45	0.62
4	A'	1688	1629	6.97	26.40	0.43	0.60
5	A'	1439	1389	15.06	9.05	0.44	0.61
6	A'	1394	1345	9.87	3.51	0.61	0.76
7	A'	1070	1033	23.89	10.23	0.50	0.67
8	A"	1159	1118	9.12	0.97	0.75	0.86
9	A"	798	770	143.47	1.07	0.75	0.86

Atom	x (Å)	y (Å)
C1	0.063	0.789
N2	0.063	-0.523
H3	-1.010	1.087
H4	-0.749	-1.143
H5	0.945	-1.022

	C1	N2	H3	H4	H5
C1		1.3122	1.1135	2.0957	2.0147
N2	1.3122		1.9345	1.0212	1.0136
H3	1.1135	1.9345		2.2451	2.8758
H4	2.0957	1.0212	2.2451		1.6979
H5	2.0147	1.0136	2.8758	1.6979

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H4	127.402		C1	N2	H5	119.515
N2	C1	H3	105.496		H4	N2	H5	113.083

All results from a given calculation for CHNH₂ (aminomethylene)

using model chemistry: G4

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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	C	-0.284
2	N	-0.316
3	H	0.088
4	H	0.244
5	H	0.268

	x	y	z	Total
	-1.099	-3.157	0.000	3.343
CHELPG
AIM
ESP

<r²>	19.667
(<r²>)^1/2	4.435

All results from a given calculation for CHNH2 (aminomethylene)

using model chemistry: G4

States and conformations

All results from a given calculation for CHNH₂ (aminomethylene)