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	hartrees
Energy at 0K	-417.699643
Energy at 298.15K	-417.704119
HF Energy	-417.359701
Nuclear repulsion energy	64.960272

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2509	2378	92.48
2	A₁	1274	1207	236.78
3	A₁	1171	1110	2.27
4	E	2490	2360	124.88
4	E	2490	2360	124.88
5	E	1179	1118	40.83
5	E	1179	1118	40.83
6	E	848	803	33.21
6	E	848	803	33.21

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.388
O2	0.000	0.000	-1.115
H3	0.000	1.253	1.034
H4	-1.086	-0.627	1.034
H5	1.086	-0.627	1.034

	P1	O2	H3	H4	H5
P1		1.5033	1.4104	1.4104	1.4104
O2	1.5033		2.4885	2.4885	2.4885
H3	1.4104	2.4885		2.1711	2.1711
H4	1.4104	2.4885	2.1711		2.1711
H5	1.4104	2.4885	2.1711	2.1711

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	P1	H3	117.284	O2	P1	H4	117.284
O2	P1	H5	117.284	H3	P1	H4	100.649
H3	P1	H5	100.649	H4	P1	H5	100.649

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

using model chemistry: MP2/TZVP

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/TZVP

States and conformations

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