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	hartrees
Energy at 0K	-380.335164
Energy at 298.15K	-380.338372
HF Energy	-380.335164
Nuclear repulsion energy	49.165457

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3369	3061	0.30
2	A'	3280	2981	5.51
3	A'	2486	2259	112.56
4	A'	1578	1434	3.45
5	A'	1120	1018	32.34
6	A'	1089	990	0.49
7	A'	798	725	2.06
8	A"	1028	934	67.27
9	A"	940	854	15.14

Atom	x (Å)	y (Å)
C1	0.056	1.058
P2	0.056	-0.586
H3	-0.826	1.670
H4	0.991	1.587
H5	-1.337	-0.811

	C1	P2	H3	H4	H5
C1		1.6436	1.0735	1.0750	2.3304
P2	1.6436		2.4220	2.3661	1.4110
H3	1.0735	2.4220		1.8192	2.5326
H4	1.0750	2.3661	1.8192		3.3424
H5	2.3304	1.4110	2.5326	3.3424

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	P2	H5	99.161		P2	C1	H3	124.770
P2	C1	H4	119.516		H3	C1	H4	115.714

All results from a given calculation for CH₂PH (Phosphaethene)

using model chemistry: HF/6-311+G(3df,2p)

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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Number	Element	Mulliken
1	C	-0.378
2	P	0.124
3	H	0.137
4	H	0.133
5	H	-0.017

	x	y	z	Total
	-0.577	0.887	0.000	1.059
CHELPG
AIM
ESP

	x	y	z
x	5.235	0.250	0.000
y	0.250	7.803	0.000
z	0.000	0.000	4.836

<r²>	34.257
(<r²>)^1/2	5.853

All results from a given calculation for CH2PH (Phosphaethene)

using model chemistry: HF/6-311+G(3df,2p)

States and conformations

All results from a given calculation for CH₂PH (Phosphaethene)