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	hartrees
Energy at 0K	-23.839017
Energy at 298.15K	-23.843372
HF Energy	-23.636683
Nuclear repulsion energy	19.636538

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2325	2269	109.21
2	A₁	1175	1147	176.88
3	A₁	957	934	74.63
4	E	2332	2276	131.81
4	E	2332	2276	131.81
5	E	1096	1069	50.86
5	E	1096	1069	50.86
6	E	750	732	11.86
6	E	750	732	11.86

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.424
O2	0.000	0.000	-1.198
H3	0.000	1.290	1.074
H4	-1.117	-0.645	1.074
H5	1.117	-0.645	1.074

	P1	O2	H3	H4	H5
P1		1.6220	1.4448	1.4448	1.4448
O2	1.6220		2.6132	2.6132	2.6132
H3	1.4448	2.6132		2.2346	2.2346
H4	1.4448	2.6132	2.2346		2.2346
H5	1.4448	2.6132	2.2346	2.2346

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	P1	H3	116.756	O2	P1	H4	116.756
O2	P1	H5	116.756	H3	P1	H4	101.303
H3	P1	H5	101.303	H4	P1	H5	101.303

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)