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	hartrees
Energy at 0K	-304.813274
Energy at 298.15K	-304.814834
HF Energy	-304.813274
Nuclear repulsion energy

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	1787	1762	247.17
2	A'	1221	1203	97.14
3	A'	714	704	33.24
4	A'	463	456	149.20
5	A'	180	178	7.97
6	A"	543	535	0.55

Atom	x (Å)	y (Å)
F1	1.636	0.185
O2	0.000	0.844
N3	-0.910	0.064
O4	-1.045	-1.108

	F1	O2	N3	O4
F1		1.7641	2.5491	2.9767
O2	1.7641		1.1981	2.2134
N3	2.5491	1.1981		1.1793
O4	2.9767	2.2134	1.1793

Number	Element	Mulliken
1	F	-0.314
2	O	0.131
3	N	0.211
4	O	-0.028

All results from a given calculation for FONO (Nitrosyl hypofluorite)

using model chemistry: B97D3/TZVP

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
You are here: Calculated > Energy > Optimized > Energy

	x	y	z	Total
	-2.912	0.230	0.000	2.921
CHELPG
AIM
ESP

	x	y	z
x	5.893	0.981	0.000
y	0.981	3.401	0.000
z	0.000	0.000	1.391

<r²>	67.814
(<r²>)^1/2	8.235