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	hartrees
Energy at 0K	-417.854695
Energy at 298.15K	-417.859236
HF Energy	-417.400613
Nuclear repulsion energy	65.397187

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2455	2455
2	A₁	1241	1241
3	A₁	1141	1141
4	E	2443	2443
4	E	2443	2443
5	E	1141	1141
5	E	1140	1140
6	E	839	839
6	E	839	839

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.385
O2	0.000	0.000	-1.105
H3	0.000	1.256	1.022
H4	-1.088	-0.628	1.022
H5	1.088	-0.628	1.022

	P1	O2	H3	H4	H5
P1		1.4899	1.4086	1.4086	1.4086
O2	1.4899		2.4703	2.4703	2.4703
H3	1.4086	2.4703		2.1760	2.1760
H4	1.4086	2.4703	2.1760		2.1760
H5	1.4086	2.4703	2.1760	2.1760

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	P1	H3	116.891	O2	P1	H4	116.891
O2	P1	H5	116.891	H3	P1	H4	101.136
H3	P1	H5	101.136	H4	P1	H5	101.136

All results from a given calculation for H₃PO (Phosphine oxide)

using model chemistry: MP4/aug-cc-pV(T+d)Z

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 H3PO (Phosphine oxide)

using model chemistry: MP4/aug-cc-pV(T+d)Z

States and conformations

All results from a given calculation for H₃PO (Phosphine oxide)