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	hartrees
Energy at 0K	-956.157904
Energy at 298.15K	-956.161478
Nuclear repulsion energy	428.331242

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	876	792	109.55
2	A₁	643	581	1.47
3	A₁	594	537	57.96
4	B₁	430	389	0.00
5	B₂	617	558	0.00
6	B₂	328	296	0.00
7	E	851	770	704.80
7	E	851	770	704.80
8	E	568	514	0.25
8	E	568	514	0.25
9	E	342	309	3.18
9	E	342	309	3.18

Atom	x (Å)	y (Å)	z (Å)
Cl1	0.000	0.000	0.311
F2	0.000	0.000	-1.277
F3	0.000	1.629	0.172
F4	-1.629	0.000	0.172
F5	0.000	-1.629	0.172
F6	1.629	0.000	0.172

	Cl1	F2	F3	F4	F5	F6
Cl1		1.5883	1.6353	1.6353	1.6353	1.6353
F2	1.5883		2.1810	2.1810	2.1810	2.1810
F3	1.6353	2.1810		2.3044	3.2589	2.3044
F4	1.6353	2.1810	2.3044		2.3044	3.2589
F5	1.6353	2.1810	3.2589	2.3044		2.3044
F6	1.6353	2.1810	2.3044	3.2589	2.3044

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Cl1	F3	85.137	F2	Cl1	F4	85.137
F2	Cl1	F5	85.137	F2	Cl1	F6	85.137
F3	Cl1	F4	89.588	F3	Cl1	F5	170.275
F3	Cl1	F6	89.588	F4	Cl1	F5	89.588
F4	Cl1	F6	170.275	F5	Cl1	F6	89.588

All results from a given calculation for ClF₅ (chlorinepentafluoride)

using model chemistry: HF/6-31+G**

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	Cl	2.404
2	F	-0.424
3	F	-0.495
4	F	-0.495
5	F	-0.495
6	F	-0.495

	x	y	z	Total
	0.000	0.000	0.793	0.793
CHELPG
AIM
ESP

<r²>	137.256
(<r²>)^1/2	11.716

All results from a given calculation for ClF5 (chlorinepentafluoride)

using model chemistry: HF/6-31+G**

States and conformations

All results from a given calculation for ClF₅ (chlorinepentafluoride)