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	hartrees
Energy at 0K	-24.074228
Energy at 298.15K	-24.078668
HF Energy	-23.772197
Nuclear repulsion energy	20.502091

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2419	2304	94.01
2	A₁	1239	1181	205.60
3	A₁	1131	1077	2.60
4	E	2420	2306	121.78
4	E	2420	2306	121.78
5	E	1117	1065	39.11
5	E	1117	1065	39.11
6	E	834	794	23.41
6	E	834	794	23.41

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.392
O2	0.000	0.000	-1.127
H3	0.000	1.273	1.045
H4	-1.102	-0.636	1.045
H5	1.102	-0.636	1.045

	P1	O2	H3	H4	H5
P1		1.5191	1.4306	1.4306	1.4306
O2	1.5191		2.5176	2.5176	2.5176
H3	1.4306	2.5176		2.2047	2.2047
H4	1.4306	2.5176	2.2047		2.2047
H5	1.4306	2.5176	2.2047	2.2047

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	P1	H3	117.159	O2	P1	H4	117.159
O2	P1	H5	117.159	H3	P1	H4	100.805
H3	P1	H5	100.805	H4	P1	H5	100.805

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

using model chemistry: MP2/CEP-121G*

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: MP2/CEP-121G*

States and conformations

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