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	hartrees
Energy at 0K	-16.289311
Energy at 298.15K	-16.290698
HF Energy	-16.289311
Nuclear repulsion energy	15.112940

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3205	2895	1.09
2	A₁	1607	1452	14.02
3	A₁	1395	1260	0.16
4	B₁	1017	919	36.96
5	B₂	3297	2979	21.21
6	B₂	1061	958	16.74

Atom	y (Å)	z (Å)
C1	0.000	-0.518
N2	0.000	0.750
H3	0.933	-1.072
H4	-0.933	-1.072

	C1	N2	H3	H4
C1		1.2683	1.0854	1.0854
N2	1.2683		2.0477	2.0477
H3	1.0854	2.0477		1.8660
H4	1.0854	2.0477	1.8660

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
N2	C1	H3	120.727		N2	C1	H4	120.727
H3	C1	H4	118.546

All results from a given calculation for H₂CN (Dihydrogen cyanide radical)

using model chemistry: HF/CEP-121G*

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	-0.090
3	H	0.187
4	H	0.187

	x	y	z	Total
	0.000	0.000	-2.453	2.453
CHELPG
AIM
ESP

<r²>	15.603
(<r²>)^1/2	3.950

All results from a given calculation for H2CN (Dihydrogen cyanide radical)

using model chemistry: HF/CEP-121G*

States and conformations

All results from a given calculation for H₂CN (Dihydrogen cyanide radical)