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	hartrees
Energy at 0K	-92.678646
Energy at 298.15K	-92.679884
HF Energy	-92.678646
Nuclear repulsion energy	26.861274

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3518	3092	1.04
2	A₁	1773	1558	25.87
3	A₁	1430	1257	35.77
4	B₁	718	631	181.22
5	B₂	3669	3224	0.22
6	B₂	1024	900	0.71

Atom	y (Å)	z (Å)
C1	0.000	-0.886
N2	0.000	0.458
H3	0.866	1.055
H4	-0.866	1.055

	C1	N2	H3	H4
C1		1.3449	2.1260	2.1260
N2	1.3449		1.0519	1.0519
H3	2.1260	1.0519		1.7329
H4	2.1260	1.0519	1.7329

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	N2	H3	124.547		C1	N2	H4	124.547
H3	N2	H4	110.906

All results from a given calculation for CNH₂ (Aminomethylidyne radical)

using model chemistry: mPW1PW91/STO-3G

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	-0.033
2	N	-0.375
3	H	0.204
4	H	0.204

	x	y	z	Total
	0.000	0.000	3.008	3.008
CHELPG
AIM
ESP

<r²>	16.723
(<r²>)^1/2	4.089

All results from a given calculation for CNH2 (Aminomethylidyne radical)

using model chemistry: mPW1PW91/STO-3G

States and conformations

All results from a given calculation for CNH₂ (Aminomethylidyne radical)