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	hartrees
Energy at 0K	-639.298375
Energy at 298.15K	-639.300535
Nuclear repulsion energy	193.857450

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	979	891	169.92
2	A₁	534	486	41.41
3	E	942	857	220.60
3	E	942	857	220.60
4	E	381	347	6.42
4	E	381	347	6.42

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.495
F2	0.000	1.342	-0.275
F3	1.162	-0.671	-0.275
F4	-1.162	-0.671	-0.275
X5	0.000	0.000	1.495

	P1	F2	F3	F4	X5
P1		1.5471	1.5471	1.5471	1.0000
F2	1.5471		2.3242	2.3242	2.2211
F3	1.5471	2.3242		2.3242	2.2211
F4	1.5471	2.3242	2.3242		2.2211
X5	1.0000	2.2211	2.2211	2.2211

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	P1	F3	97.383	F2	P1	F4	97.383
F2	P1	X5	119.845	F3	P1	F4	97.383
F3	P1	X5	119.845	F4	P1	X5	119.845

All results from a given calculation for PF₃ (Phosphorus trifluoride)

using model chemistry: HF/cc-pVTZ

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	CHELPG	ESP
1	P	0.923	0.318	0.295
2	F	-0.308	-0.107	-0.097
3	F	-0.308	-0.106	-0.099
4	F	-0.308	-0.106	-0.099

	x	y	z	Total
	0.000	0.000	1.074	1.074
CHELPG
AIM
ESP	-0.001	0.009	1.089	1.089

<r²>	71.508
(<r²>)^1/2	8.456

All results from a given calculation for PF3 (Phosphorus trifluoride)

using model chemistry: HF/cc-pVTZ

States and conformations

All results from a given calculation for PF₃ (Phosphorus trifluoride)