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	hartrees
Energy at 0K	-382.460853
Energy at 298.15K	-382.466465
HF Energy	-382.460853
Nuclear repulsion energy	59.969006

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3161	3024	8.80
2	A'	3067	2933	16.47
3	A'	2396	2292	70.66
4	A'	1480	1416	6.45
5	A'	1348	1289	0.84
6	A'	1135	1086	21.64
7	A'	1010	966	62.27
8	A'	752	719	0.80
9	A'	692	662	8.89
10	A"	3149	3012	8.43
11	A"	2401	2297	89.56
12	A"	1478	1414	8.80
13	A"	1047	1001	23.81
14	A"	705	674	0.87
15	A"	228	218	2.92

Atom	x (Å)	y (Å)	z (Å)
C1	0.070	1.185	0.000
P2	0.070	-0.673	0.000
H3	-0.929	1.623	0.000
H4	0.610	1.536	0.881
H5	0.610	1.536	-0.881
H6	-0.882	-0.858	-1.036
H7	-0.882	-0.858	1.036

	C1	P2	H3	H4	H5	H6	H7
C1		1.8583	1.0904	1.0915	1.0915	2.4807	2.4807
P2	1.8583		2.5039	2.4391	2.4391	1.4191	1.4191
H3	1.0904	2.5039		1.7754	1.7754	2.6889	2.6889
H4	1.0915	2.4391	1.7754		1.7622	3.4108	2.8254
H5	1.0915	2.4391	1.7754	1.7622		2.8254	3.4108
H6	2.4807	1.4191	2.6889	3.4108	2.8254		2.0718
H7	2.4807	1.4191	2.6889	2.8254	3.4108	2.0718

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	P2	H6	97.485	C1	P2	H7	97.485
P2	C1	H3	113.674	P2	C1	H4	108.760
P2	C1	H5	108.760	H3	C1	H4	108.912
H3	C1	H5	108.912	H4	C1	H5	107.655
H6	P2	H7	93.767

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

using model chemistry: wB97X-D/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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Number	Element	Mulliken
1	C	-0.586
2	P	0.170
3	H	0.153
4	H	0.151
5	H	0.151
6	H	-0.019
7	H	-0.019

	x	y	z	Total
	-0.716	1.059	0.000	1.279
CHELPG
AIM
ESP

	x	y	z
x	4.876	0.328	0.000
y	0.328	5.868	0.000
z	0.000	0.000	5.174

<r²>	44.968
(<r²>)^1/2	6.706

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

using model chemistry: wB97X-D/6-311G**

States and conformations

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