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	hartrees
Energy at 0K	-13.484533
Energy at 298.15K	-13.487734
HF Energy	-13.484533
Nuclear repulsion energy	15.665395

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3453	3113	10.69
2	A'	3341	3011	13.85
3	A'	2368	2135	241.60
4	A'	1590	1433	6.59
5	A'	1129	1018	67.71
6	A'	1023	922	0.25
7	A'	830	748	3.78
8	A"	1045	942	103.08
9	A"	920	829	15.16

Atom	x (Å)	y (Å)
C1	0.057	1.095
P2	0.057	-0.605
H3	-0.829	1.713
H4	0.999	1.624
H5	-1.373	-0.824

	C1	P2	H3	H4	H5
C1		1.7001	1.0804	1.0804	2.3927
P2	1.7001		2.4821	2.4198	1.4466
H3	1.0804	2.4821		1.8300	2.5946
H4	1.0804	2.4198	1.8300		3.4082
H5	2.3927	1.4466	2.5946	3.4082

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
C1	P2	H5	98.677		P2	C1	H3	124.929
P2	C1	H4	119.308		H3	C1	H4	115.763

All results from a given calculation for CH₂PH (Phosphaethene)

using model chemistry: HF/CEP-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	-0.482
2	P	0.182
3	H	0.202
4	H	0.199
5	H	-0.100

	x	y	z	Total
	-0.948	1.374	0.000	1.669
CHELPG
AIM
ESP

	x	y	z
x	3.916	0.478	0.000
y	0.478	7.741	0.000
z	0.000	0.000	2.594

<r²>	29.011
(<r²>)^1/2	5.386

All results from a given calculation for CH2PH (Phosphaethene)

using model chemistry: HF/CEP-31G

States and conformations

All results from a given calculation for CH₂PH (Phosphaethene)