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	hartrees
Energy at 0K	-679.465225
Energy at 298.15K	-679.469133
HF Energy	-678.293175
Nuclear repulsion energy	275.716222

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3256	3091	18.27
2	A'	1397	1326	77.23
3	A'	1173	1114	226.62
4	A'	915	869	175.39
5	A'	832	790	71.67
6	A'	510	484	54.90
7	A'	478	454	69.27
8	A'	379	360	53.32
9	A'	271	257	0.75
10	A"	3352	3182	10.87
11	A"	1008	957	209.89
12	A"	808	768	1.11
13	A"	453	430	0.98
14	A"	364	345	14.80
15	A"	190	180	0.60

Atom	x (Å)	y (Å)	z (Å)
P1	-0.025	0.115	0.000
C2	-0.488	1.655	0.000
F3	1.457	-0.383	0.000
F4	-0.488	-0.698	1.228
F5	-0.488	-0.698	-1.228
H6	-0.512	2.182	-0.932
H7	-0.512	2.182	0.932

	P1	C2	F3	F4	F5	H6	H7
P1		1.6082	1.5630	1.5442	1.5442	2.3196	2.3196
C2	1.6082		2.8171	2.6544	2.6544	1.0714	1.0714
F3	1.5630	2.8171		2.3217	2.3217	3.3653	3.3653
F4	1.5442	2.6544	2.3217		2.4564	3.6009	2.8958
F5	1.5442	2.6544	2.3217	2.4564		2.8958	3.6009
H6	2.3196	1.0714	3.3653	3.6009	2.8958		1.8648
H7	2.3196	1.0714	3.3653	2.8958	3.6009	1.8648

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H6	118.531	P1	C2	H7	118.531
C2	P1	F3	125.326	C2	P1	F4	114.697
C2	P1	F5	114.697	F3	P1	F4	96.699
F3	P1	F5	96.699	F4	P1	F5	105.383
H6	C2	H7	120.971

All results from a given calculation for PF₃CH₂ (phosphorane, trifluoromethylene-)

using model chemistry: MP2=FULL/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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All results from a given calculation for PF3CH2 (phosphorane, trifluoromethylene-)

using model chemistry: MP2=FULL/cc-pVTZ

States and conformations

All results from a given calculation for PF₃CH₂ (phosphorane, trifluoromethylene-)