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	hartrees
Energy at 0K	-417.838391
Energy at 298.15K	-417.842869
HF Energy	-417.398253
Nuclear repulsion energy	65.798172

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	2455	2369
2	A₁	1289	1244
3	A₁	1172	1131
4	E	2439	2353
4	E	2438	2353
5	E	1148	1107
5	E	1147	1107
6	E	859	828
6	E	858	828

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.380
O2	0.000	0.000	-1.097
H3	0.000	1.253	1.023
H4	-1.085	-0.627	1.023
H5	1.085	-0.627	1.023

	P1	O2	H3	H4	H5
P1		1.4767	1.4085	1.4085	1.4085
O2	1.4767		2.4625	2.4625	2.4625
H3	1.4085	2.4625		2.1705	2.1705
H4	1.4085	2.4625	2.1705		2.1705
H5	1.4085	2.4625	2.1705	2.1705

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	P1	H3	117.168	O2	P1	H4	117.168
O2	P1	H5	117.168	H3	P1	H4	100.794
H3	P1	H5	100.794	H4	P1	H5	100.794

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

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

States and conformations

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