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	hartrees
Energy at 0K	-381.423165
Energy at 298.15K	-381.428848
Nuclear repulsion energy	59.201659

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A	3317	2995	12.50
2	A	3220	2908	27.46
3	A	2407	2173	135.85
4	A	1632	1473	10.32
5	A	1497	1351	0.47
6	A	1212	1095	27.93
7	A	1099	992	55.54
8	A	799	721	3.57
9	A	701	633	3.30
10	A	3314	2992	10.65
11	A	2410	2176	186.79
12	A	1634	1475	11.09
13	A	1135	1024	27.65
14	A	768	694	5.31
15	A	219	197	4.12

Atom	x (Å)	y (Å)	z (Å)
C1	0.069	1.219	0.000
P2	0.069	-0.685	0.000
H3	-0.929	1.632	0.000
H4	0.599	1.566	0.876
H5	0.599	1.566	-0.876
H6	-0.860	-0.904	-1.064
H7	-0.860	-0.904	1.064

	C1	P2	H3	H4	H5	H6	H7
C1		1.9042	1.0803	1.0810	1.0810	2.5496	2.5496
P2	1.9042		2.5229	2.4728	2.4728	1.4288	1.4288
H3	1.0803	2.5229		1.7628	1.7628	2.7505	2.7505
H4	1.0810	2.4728	1.7628		1.7523	3.4624	2.8742
H5	1.0810	2.4728	1.7628	1.7523		2.8742	3.4624
H6	2.5496	1.4288	2.7505	3.4624	2.8742		2.1272
H7	2.5496	1.4288	2.7505	2.8742	3.4624	2.1272

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	P2	H6	98.804	C1	P2	H7	98.804
P2	C1	H3	112.455	P2	C1	H4	108.704
P2	C1	H5	108.704	H3	C1	H4	109.298
H3	C1	H5	109.298	H4	C1	H5	108.292
H6	P2	H7	96.218

All results from a given calculation for CH₃PH₂ (Methyl phosphine)

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	CHELPG
1	C	-0.774	0.280
2	P	0.336	-0.394
3	H	0.187	-0.075
4	H	0.189	-0.022
5	H	0.189	-0.022
6	H	-0.064	0.117
7	H	-0.064	0.117

	x	y	z	Total
	-0.948	1.174	0.000	1.509
CHELPG	-0.797	0.992	0.000	1.273
AIM
ESP

	x	y	z
x	4.059	0.530	0.000
y	0.530	5.378	0.000
z	0.000	0.000	4.792

<r²>	46.374
(<r²>)^1/2	6.810

All results from a given calculation for CH3PH2 (Methyl phosphine)

using model chemistry: HF/6-31G

States and conformations

All results from a given calculation for CH₃PH₂ (Methyl phosphine)