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	hartrees
Energy at 0K	-511.204209
Energy at 298.15K	-511.206422
Nuclear repulsion energy	256.162493

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	618	556	43.27
2	A₁	471	424	61.16
3	A₁	414	373	41.78
4	B₁	297	267	0.00
5	B₂	523	471	0.00
6	B₂	231	208	0.00
7	E	733	660	415.44
7	E	733	660	415.44
8	E	383	345	2.46
8	E	383	345	2.46
9	E	230	207	0.06
9	E	230	207	0.06

Atom	x (Å)	y (Å)	z (Å)
Cl1	0.000	0.000	0.389
F2	0.000	0.000	-1.422
F3	0.000	1.785	0.172
F4	-1.785	0.000	0.172
F5	0.000	-1.785	0.172
F6	1.785	0.000	0.172

	Cl1	F2	F3	F4	F5	F6
Cl1		1.8105	1.7981	1.7981	1.7981	1.7981
F2	1.8105		2.3929	2.3929	2.3929	2.3929
F3	1.7981	2.3929		2.5243	3.5699	2.5243
F4	1.7981	2.3929	2.5243		2.5243	3.5699
F5	1.7981	2.3929	3.5699	2.5243		2.5243
F6	1.7981	2.3929	2.5243	3.5699	2.5243

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Cl1	F3	83.076	F2	Cl1	F4	83.076
F2	Cl1	F5	83.076	F2	Cl1	F6	83.076
F3	Cl1	F4	89.167	F3	Cl1	F5	166.151
F3	Cl1	F6	89.167	F4	Cl1	F5	89.167
F4	Cl1	F6	166.151	F5	Cl1	F6	89.167

All results from a given calculation for ClF₅ (chlorinepentafluoride)

using model chemistry: HF/LANL2DZ

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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Number	Element	Mulliken
1	Cl	1.539
2	F	-0.170
3	F	-0.342
4	F	-0.342
5	F	-0.342
6	F	-0.342

	x	y	z	Total
	0.000	0.000	1.687	1.687
CHELPG
AIM
ESP

<r²>	160.642
(<r²>)^1/2	12.674

All results from a given calculation for ClF5 (chlorinepentafluoride)

using model chemistry: HF/LANL2DZ

States and conformations

All results from a given calculation for ClF₅ (chlorinepentafluoride)