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	hartrees
Energy at 0K	-958.424748
Energy at 298.15K	-958.427737
Nuclear repulsion energy	417.013122

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	775	737	81.41
2	A₁	586	557	5.84
3	A₁	500	475	31.68
4	B₁	363	345	0.00
5	B₂	547	520	0.00
6	B₂	275	261	0.00
7	E	831	791	435.14
7	E	831	791	435.14
8	E	477	454	0.09
8	E	477	454	0.09
9	E	293	279	0.02
9	E	293	279	0.02

Atom	x (Å)	y (Å)	z (Å)
Cl1	0.000	0.000	0.316
F2	0.000	0.000	-1.317
F3	0.000	1.673	0.180
F4	-1.673	0.000	0.180
F5	0.000	-1.673	0.180
F6	1.673	0.000	0.180

	Cl1	F2	F3	F4	F5	F6
Cl1		1.6333	1.6782	1.6782	1.6782	1.6782
F2	1.6333		2.2451	2.2451	2.2451	2.2451
F3	1.6782	2.2451		2.3656	3.3455	2.3656
F4	1.6782	2.2451	2.3656		2.3656	3.3455
F5	1.6782	2.2451	3.3455	2.3656		2.3656
F6	1.6782	2.2451	2.3656	3.3455	2.3656

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Cl1	F3	85.358	F2	Cl1	F4	85.358
F2	Cl1	F5	85.358	F2	Cl1	F6	85.358
F3	Cl1	F4	89.625	F3	Cl1	F5	170.716
F3	Cl1	F6	89.625	F4	Cl1	F5	89.625
F4	Cl1	F6	170.716	F5	Cl1	F6	89.625

All results from a given calculation for ClF₅ (chlorinepentafluoride)

using model chemistry: HSEh1PBE/6-31G*

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	1.707
2	F	-0.280
3	F	-0.357
4	F	-0.357
5	F	-0.357
6	F	-0.357

	x	y	z	Total
	0.000	0.000	0.797	0.797
CHELPG
AIM
ESP

<r²>	142.474
(<r²>)^1/2	11.936

All results from a given calculation for ClF5 (chlorinepentafluoride)

using model chemistry: HSEh1PBE/6-31G*

States and conformations

All results from a given calculation for ClF₅ (chlorinepentafluoride)