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	hartrees
Energy at 0K	-958.462812
Energy at 298.15K	-958.465589
HF Energy	-958.462812
Nuclear repulsion energy	413.102244

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	737	704	84.43
2	A₁	548	523	6.77
3	A₁	468	447	35.53
4	B₁	349	333	0.00
5	B₂	499	477	0.00
6	B₂	259	248	0.00
7	E	766	731	513.79
7	E	766	731	513.79
8	E	461	440	0.37
8	E	461	440	0.37
9	E	280	268	0.48
9	E	280	268	0.48

Atom	x (Å)	y (Å)	z (Å)
Cl1	0.000	0.000	0.310
F2	0.000	0.000	-1.326
F3	0.000	1.691	0.185
F4	-1.691	0.000	0.185
F5	0.000	-1.691	0.185
F6	1.691	0.000	0.185

	Cl1	F2	F3	F4	F5	F6
Cl1		1.6360	1.6957	1.6957	1.6957	1.6957
F2	1.6360		2.2684	2.2684	2.2684	2.2684
F3	1.6957	2.2684		2.3916	3.3822	2.3916
F4	1.6957	2.2684	2.3916		2.3916	3.3822
F5	1.6957	2.2684	3.3822	2.3916		2.3916
F6	1.6957	2.2684	2.3916	3.3822	2.3916

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Cl1	F3	85.800	F2	Cl1	F4	85.800
F2	Cl1	F5	85.800	F2	Cl1	F6	85.800
F3	Cl1	F4	89.693	F3	Cl1	F5	171.601
F3	Cl1	F6	89.693	F4	Cl1	F5	89.693
F4	Cl1	F6	171.601	F5	Cl1	F6	89.693

All results from a given calculation for ClF₅ (chlorinepentafluoride)

using model chemistry: HSEh1PBE/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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Number	Element	Mulliken
1	Cl	1.842
2	F	-0.320
3	F	-0.380
4	F	-0.380
5	F	-0.380
6	F	-0.380

	x	y	z	Total
	0.000	0.000	0.808	0.808
CHELPG
AIM
ESP

<r²>	146.041
(<r²>)^1/2	12.085

All results from a given calculation for ClF5 (chlorinepentafluoride)

using model chemistry: HSEh1PBE/6-31+G**

States and conformations

All results from a given calculation for ClF₅ (chlorinepentafluoride)