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	hartrees
Energy at 0K	-415.284981
Energy at 298.15K	-415.289395
HF Energy	-415.082063
Nuclear repulsion energy	62.093287

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2320	2184	100.94
2	A₁	1266	1192	161.00
3	A₁	1009	950	7.82
4	E	2255	2122	169.18
4	E	2255	2122	169.18
5	E	1100	1035	59.54
5	E	1100	1035	59.54
6	E	819	771	25.03
6	E	819	771	25.03

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.415
O2	0.000	0.000	-1.181
H3	0.000	1.265	1.077
H4	-1.096	-0.633	1.077
H5	1.096	-0.633	1.077

	P1	O2	H3	H4	H5
P1		1.5959	1.4282	1.4282	1.4282
O2	1.5959		2.5887	2.5887	2.5887
H3	1.4282	2.5887		2.1914	2.1914
H4	1.4282	2.5887	2.1914		2.1914
H5	1.4282	2.5887	2.1914	2.1914

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	P1	H3	117.641	O2	P1	H4	117.641
O2	P1	H5	117.641	H3	P1	H4	100.205
H3	P1	H5	100.205	H4	P1	H5	100.205

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

using model chemistry: CISD/3-21G

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: CISD/3-21G

States and conformations

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