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	hartrees
Energy at 0K	-380.287052
Energy at 298.15K	-380.290264
HF Energy	-380.287052
Nuclear repulsion energy	48.991875

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3425	3078	1.65
2	A'	3337	2998	9.24
3	A'	2558	2299	178.14
4	A'	1613	1449	0.37
5	A'	1142	1026	44.77
6	A'	1093	982	1.32
7	A'	816	733	1.51
8	A"	1040	934	65.18
9	A"	951	855	23.96

Atom	x (Å)	y (Å)
C1	0.056	1.062
P2	0.056	-0.589
H3	-0.825	1.680
H4	0.991	1.594
H5	-1.336	-0.807

	C1	P2	H3	H4	H5
C1		1.6518	1.0752	1.0763	2.3307
P2	1.6518		2.4338	2.3756	1.4090
H3	1.0752	2.4338		1.8182	2.5385
H4	1.0763	2.3756	1.8182		3.3442
H5	2.3307	1.4090	2.5385	3.3442

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	P2	H5	98.879		P2	C1	H3	125.025
P2	C1	H4	119.610		H3	C1	H4	115.365

All results from a given calculation for CH₂PH (Phosphaethene)

using model chemistry: HF/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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Number	Element	Mulliken
1	C	-0.544
2	P	0.188
3	H	0.213
4	H	0.209
5	H	-0.066

	x	y	z	Total
	-0.606	1.138	0.000	1.289
CHELPG
AIM
ESP

	x	y	z
x	4.218	0.395	-0.000
y	0.395	7.014	0.001
z	-0.000	0.001	2.904

<r²>	34.293
(<r²>)^1/2	5.856

All results from a given calculation for CH2PH (Phosphaethene)

using model chemistry: HF/6-31G*

States and conformations

All results from a given calculation for CH₂PH (Phosphaethene)