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	hartrees
Energy at 0K	-958.975915
Energy at 298.15K	-958.978989
Nuclear repulsion energy	422.884984

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	767	735	74.77
2	A₁	570	546	3.19
3	A₁	512	490	30.11
4	B₁	379	363	0.00
5	B₂	528	505	0.00
6	B₂	287	275	0.00
7	E	790	757	435.55
7	E	790	757	435.55
8	E	504	483	0.58
8	E	504	483	0.58
9	E	302	289	0.68
9	E	302	289	0.68

Atom	x (Å)	y (Å)	z (Å)
Cl1	0.000	0.000	0.309
F2	0.000	0.000	-1.293
F3	0.000	1.652	0.177
F4	-1.652	0.000	0.177
F5	0.000	-1.652	0.177
F6	1.652	0.000	0.177

	Cl1	F2	F3	F4	F5	F6
Cl1		1.6015	1.6570	1.6570	1.6570	1.6570
F2	1.6015		2.2112	2.2112	2.2112	2.2112
F3	1.6570	2.2112		2.3360	3.3036	2.3360
F4	1.6570	2.2112	2.3360		2.3360	3.3036
F5	1.6570	2.2112	3.3036	2.3360		2.3360
F6	1.6570	2.2112	2.3360	3.3036	2.3360

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Cl1	F3	85.450	F2	Cl1	F4	85.450
F2	Cl1	F5	85.450	F2	Cl1	F6	85.450
F3	Cl1	F4	89.639	F3	Cl1	F5	170.899
F3	Cl1	F6	89.639	F4	Cl1	F5	89.639
F4	Cl1	F6	170.899	F5	Cl1	F6	89.639

All results from a given calculation for ClF₅ (chlorinepentafluoride)

using model chemistry: B1B95/6-31G(2df,p)

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	0.953
2	F	-0.091
3	F	-0.215
4	F	-0.215
5	F	-0.215
6	F	-0.215

	x	y	z	Total
	0.000	0.000	0.557	0.557
CHELPG
AIM
ESP

<r²>	138.889
(<r²>)^1/2	11.785

All results from a given calculation for ClF5 (chlorinepentafluoride)

using model chemistry: B1B95/6-31G(2df,p)

States and conformations

All results from a given calculation for ClF₅ (chlorinepentafluoride)