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	hartrees
Energy at 0K	-175.576524
Energy at 298.15K
HF Energy	-175.576524
Nuclear repulsion energy	32.722454

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'	3584	3570	24.83	48.40	0.35	0.51
2	A'	1320	1315	51.45	6.36	0.72	0.83
3	A'	868	865	4.66	8.79	0.32	0.48

Atom	x (Å)	y (Å)
O1	0.054	0.730
H2	-0.920	0.854
F3	0.054	-0.743

	O1	H2	F3
O1		0.9822	1.4730
H2	0.9822		1.8710
F3	1.4730	1.8710

Number	Element	Mulliken
1	O	-0.125
2	H	0.276
3	F	-0.151

All results from a given calculation for HOF (Hypofluorous acid)

using model chemistry: BLYP/6-311G**

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
	-1.795	0.934	0.000	2.023
CHELPG
AIM
ESP

	x	y	z
x	1.018	-0.165	0.000
y	-0.165	1.801	0.000
z	0.000	0.000	0.549

<r²>	17.109
(<r²>)^1/2	4.136