CCCBDB listing of experimental data page 2

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Property	Value	units	Reference
Hfg(298.15K)	-488.26	kJ mol^-1	webbook
Hfg(0K)		kJ mol^-1	webbook
Entropy (298.15K)	262.96	J K^-1 mol^-1	webbook
Integrated Heat Capacity (0 to 298.15K)		kJ mol^-1
Heat Capacity (298.15K)	44.71	J K^-1 mol^-1	webbook

Mode Number	Symmetry	Frequency			Intensity			Comment	Description
Mode Number	Symmetry	Fundamental(cm^-1)	Harmonic(cm^-1)	Reference	(km mol^-1)	unc.	Reference	Comment	Description
1	A₁	841		webbook
2	A₁	366
3	B₂	848

Description	Value	unc.	Connectivity				Reference	Comment
Description	Value	unc.	Atom 1	Atom 2	Atom 3	Atom 4	Reference	Comment
rPF	1.579		1	2			1998Sai/End:1778-1784	r0
aFPF	98.48		2	1	3		1998Sai/End:1778-1784

Atom	y (Å)	z (Å)
P1	0.0000	0.5624
F2	1.1962	-0.4687
F3	-1.1962	-0.4687

	P1	F2	F3
P1		1.5792	1.5792
F2	1.5792		2.3923
F3	1.5792	2.3923

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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State	Config	State description	Conf description	Exp. min.	Dipole (Debye)				Reference	comment	Point Group	Components
State	Config	State description	Conf description	Exp. min.	x	y	z	total	Reference	comment	Point Group	dipole	quadrupole
1	1	¹A₁	C_2v	True							C_2v	1	2

squib	reference	DOI
1998Sai/End:1778-1784	S Saito, Y Endo, and E Hirota "The microwave spectrum of the PF2 radical in the X̃ 2B1 ground vibronic state" J. Chem. Phys.85, 1778 (1986)	10.1063/1.451837 Submitted: 06 February 1986 . Accepted: 22 April 1986 . Published Online: 31
webbook	NIST Chemistry Webbook (http://webbook.nist.gov/chemistry)	10.18434/T4D303

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Experimental data for PF2+ (Phosphorus difluoride cation)

Experimental data for PF₂⁺ (Phosphorus difluoride cation)