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	hartrees
Energy at 0K	-417.371844
Energy at 298.15K	-417.376160
HF Energy	-417.154897
Nuclear repulsion energy	60.926813

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2290	2198	104.51
2	A₁	1176	1128	146.92
3	A₁	918	881	26.79
4	E	2277	2184	152.67
4	E	2277	2184	152.67
5	E	1054	1011	46.93
5	E	1054	1011	46.93
6	E	743	713	13.53
6	E	743	713	13.53

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.428
O2	0.000	0.000	-1.206
H3	0.000	1.288	1.076
H4	-1.116	-0.644	1.076
H5	1.116	-0.644	1.076

	P1	O2	H3	H4	H5
P1		1.6344	1.4418	1.4418	1.4418
O2	1.6344		2.6205	2.6205	2.6205
H3	1.4418	2.6205		2.2312	2.2312
H4	1.4418	2.6205	2.2312		2.2312
H5	1.4418	2.6205	2.2312	2.2312

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	P1	H3	116.689	O2	P1	H4	116.689
O2	P1	H5	116.689	H3	P1	H4	101.385
H3	P1	H5	101.385	H4	P1	H5	101.385

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

using model chemistry: CCD/6-31G

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: CCD/6-31G

States and conformations

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