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	hartrees
Energy at 0K	-1794.956946
Energy at 298.15K	-1794.958935
Nuclear repulsion energy	462.698262

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	1338	1277	159.91
2	A₁	478	456	21.27
3	A₁	279	266	3.75
4	E	595	567	267.84
4	E	595	567	267.84
5	E	338	323	12.90
5	E	338	323	12.90
6	E	198	189	0.00
6	E	198	189	0.00

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.426
O2	0.000	0.000	1.883
Cl3	0.000	1.829	-0.421
Cl4	1.584	-0.914	-0.421
Cl5	-1.584	-0.914	-0.421

	P1	O2	Cl3	Cl4	Cl5
P1		1.4572	2.0152	2.0152	2.0152
O2	1.4572		2.9413	2.9413	2.9413
Cl3	2.0152	2.9413		3.1677	3.1677
Cl4	2.0152	2.9413	3.1677		3.1677
Cl5	2.0152	2.9413	3.1677	3.1677

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
O2	P1	Cl3	114.835	O2	P1	Cl4	114.835
O2	P1	Cl5	114.835	Cl3	P1	Cl4	103.615
Cl3	P1	Cl5	103.615	Cl4	P1	Cl5	103.615

All results from a given calculation for Cl₃PO (Phosphoryl chloride)

using model chemistry: QCISD/6-311G**

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 Cl3PO (Phosphoryl chloride)

using model chemistry: QCISD/6-311G**

States and conformations

All results from a given calculation for Cl₃PO (Phosphoryl chloride)