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	hartrees
Energy at 0K	-421.068811
Energy at 298.15K	-421.076679
HF Energy	-420.547964
Nuclear repulsion energy	113.837156

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3220	3027	7.24
2	A'	3218	3024	7.41
3	A'	3114	2927	7.81
4	A'	2481	2332	69.97
5	A'	1520	1428	8.20
6	A'	1519	1427	4.51
7	A'	1358	1277	1.35
8	A'	1038	975	32.52
9	A'	987	927	31.34
10	A'	744	699	1.11
11	A'	700	658	1.62
12	A'	267	251	0.12
13	A'	203	191	0.18
14	A"	3222	3028	0.95
15	A"	3219	3025	0.90
16	A"	3118	2930	6.95
17	A"	1510	1420	7.21
18	A"	1506	1415	2.07
19	A"	1342	1261	0.89
20	A"	1059	995	26.17
21	A"	851	800	1.34
22	A"	758	713	11.77
23	A"	728	685	2.99
24	A"	202	190	0.01

Atom	x (Å)	y (Å)	z (Å)
P1	-0.037	-0.668	0.000
H2	1.348	-0.938	0.000
C3	-0.037	0.528	1.402
C4	-0.037	0.528	-1.402
H5	-1.021	0.990	1.470
H6	-1.021	0.990	-1.470
H7	0.142	0.002	2.337
H8	0.142	0.002	-2.337
H9	0.708	1.314	1.291
H10	0.708	1.314	-1.291

	P1	H2	C3	C4	H5	H6	H7	H8	H9	H10
P1		1.4113	1.8424	1.8424	2.4243	2.4243	2.4379	2.4379	2.4796	2.4796
H2	1.4113		2.4562	2.4562	3.3899	3.3899	2.7930	2.7930	2.6733	2.6733
C3	1.8424	2.4562		2.8032	1.0890	3.0705	1.0887	3.7803	1.0884	2.9024
C4	1.8424	2.4562	2.8032		3.0705	1.0890	3.7803	1.0887	2.9024	1.0884
H5	2.4243	3.3899	1.0890	3.0705		2.9401	1.7557	4.1021	1.7681	3.2739
H6	2.4243	3.3899	3.0705	1.0890	2.9401		4.1021	1.7557	3.2739	1.7681
H7	2.4379	2.7930	1.0887	3.7803	1.7557	4.1021		4.6749	1.7712	3.9000
H8	2.4379	2.7930	3.7803	1.0887	4.1021	1.7557	4.6749		3.9000	1.7712
H9	2.4796	2.6733	1.0884	2.9024	1.7681	3.2739	1.7712	3.9000		2.5824
H10	2.4796	2.6733	2.9024	1.0884	3.2739	1.7681	3.9000	1.7712	2.5824

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C3	H5	108.854	P1	C3	H7	109.870
P1	C3	H9	113.032	P1	C4	H6	108.854
P1	C4	H8	109.870	P1	C4	H10	113.032
H2	P1	C3	97.141	H2	P1	C4	97.141
C3	P1	C4	99.059	H5	C3	H7	107.447
H5	C3	H9	108.589	H6	C4	H8	107.447
H6	C4	H10	108.589	H7	C3	H9	108.890
H8	C4	H10	108.890

All results from a given calculation for CH₃PHCH₃ (dimethylphosphine)

using model chemistry: MP2=FULL/6-31G(2df,p)

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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All results from a given calculation for CH3PHCH3 (dimethylphosphine)

using model chemistry: MP2=FULL/6-31G(2df,p)

States and conformations

All results from a given calculation for CH₃PHCH₃ (dimethylphosphine)