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	hartrees
Energy at 0K	-135.320018
Energy at 298.15K	-135.321365
Nuclear repulsion energy	162.716319

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	550	536	30.38
2	A₁	424	413	10.82
3	A₁	283	276	34.51
4	B₁	228	222	0.00
5	B₂	414	404	0.00
6	B₂	154	150	0.00
7	E	681	664	225.15
7	E	681	664	225.15
8	E	289	281	1.50
8	E	289	281	1.50
9	E	181	176	0.98
9	E	181	176	0.98

Atom	x (Å)	y (Å)	z (Å)
Cl1	0.000	0.000	0.355
F2	0.000	0.000	-1.498
F3	0.000	1.879	0.207
F4	-1.879	0.000	0.207
F5	0.000	-1.879	0.207
F6	1.879	0.000	0.207

	Cl1	F2	F3	F4	F5	F6
Cl1		1.8530	1.8850	1.8850	1.8850	1.8850
F2	1.8530		2.5376	2.5376	2.5376	2.5376
F3	1.8850	2.5376		2.6575	3.7583	2.6575
F4	1.8850	2.5376	2.6575		2.6575	3.7583
F5	1.8850	2.5376	3.7583	2.6575		2.6575
F6	1.8850	2.5376	2.6575	3.7583	2.6575

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Cl1	F3	85.508	F2	Cl1	F4	85.508
F2	Cl1	F5	85.508	F2	Cl1	F6	85.508
F3	Cl1	F4	89.649	F3	Cl1	F5	171.017
F3	Cl1	F6	89.649	F4	Cl1	F5	89.649
F4	Cl1	F6	171.017	F5	Cl1	F6	89.649

All results from a given calculation for ClF₅ (chlorinepentafluoride)

using model chemistry: B3LYP/CEP-121G

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	1.255
2	F	-0.139
3	F	-0.279
4	F	-0.279
5	F	-0.279
6	F	-0.279

	x	y	z	Total
	0.000	0.000	1.458	1.458
CHELPG
AIM
ESP

<r²>	141.792
(<r²>)^1/2	11.908

All results from a given calculation for ClF5 (chlorinepentafluoride)

using model chemistry: B3LYP/CEP-121G

States and conformations

All results from a given calculation for ClF₅ (chlorinepentafluoride)