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	hartrees
Energy at 0K	-418.620567
Energy at 298.15K	-418.628323
HF Energy	-418.363308
Nuclear repulsion energy	110.368293

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3189	3045	10.87
2	A'	3185	3041	17.66
3	A'	3096	2956	13.59
4	A'	2233	2132	105.91
5	A'	1580	1509	5.27
6	A'	1577	1506	15.42
7	A'	1431	1366	0.90
8	A'	1065	1017	29.08
9	A'	1021	975	39.04
10	A'	736	702	4.55
11	A'	628	600	0.97
12	A'	251	240	0.25
13	A'	183	175	0.06
14	A"	3189	3045	2.08
15	A"	3185	3041	3.06
16	A"	3098	2958	13.05
17	A"	1570	1499	12.94
18	A"	1567	1496	0.54
19	A"	1412	1348	0.85
20	A"	1062	1014	27.46
21	A"	900	860	0.94
22	A"	754	720	0.93
23	A"	675	644	7.57
24	A"	178	170	0.02

Atom	x (Å)	y (Å)	z (Å)
P1	-0.039	-0.696	0.000
H2	1.383	-0.962	0.000
C3	-0.039	0.556	1.460
C4	-0.039	0.556	-1.460
H5	-1.035	1.000	1.533
H6	-1.035	1.000	-1.533
H7	0.175	0.019	2.387
H8	0.175	0.019	-2.387
H9	0.702	1.346	1.315
H10	0.702	1.346	-1.315

	P1	H2	C3	C4	H5	H6	H7	H8	H9	H10
P1		1.4468	1.9226	1.9226	2.4930	2.4930	2.5012	2.5012	2.5389	2.5389
H2	1.4468		2.5410	2.5410	3.4705	3.4705	2.8497	2.8497	2.7419	2.7419
C3	1.9226	2.5410		2.9194	1.0929	3.1847	1.0931	3.8904	1.0935	2.9785
C4	1.9226	2.5410	2.9194		3.1847	1.0929	3.8904	1.0931	2.9785	1.0935
H5	2.4930	3.4705	1.0929	3.1847		3.0650	1.7772	4.2182	1.7850	3.3533
H6	2.4930	3.4705	3.1847	1.0929	3.0650		4.2182	1.7772	3.3533	1.7850
H7	2.5012	2.8497	1.0931	3.8904	1.7772	4.2182		4.7749	1.7862	3.9680
H8	2.5012	2.8497	3.8904	1.0931	4.2182	1.7772	4.7749		3.9680	1.7862
H9	2.5389	2.7419	1.0935	2.9785	1.7850	3.3533	1.7862	3.9680		2.6292
H10	2.5389	2.7419	2.9785	1.0935	3.3533	1.7850	3.9680	1.7862	2.6292

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C3	H5	108.371	P1	C3	H7	108.949
P1	C3	H9	111.690	P1	C4	H6	108.371
P1	C4	H8	108.949	P1	C4	H10	111.690
H2	P1	C3	96.885	H2	P1	C4	96.885
C3	P1	C4	98.795	H5	C3	H7	108.772
H5	C3	H9	109.454	H6	C4	H8	108.772
H6	C4	H10	109.454	H7	C3	H9	109.550
H8	C4	H10	109.550

All results from a given calculation for CH₃PHCH₃ (dimethylphosphine)

using model chemistry: MP2=FULL/3-21G

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/3-21G

States and conformations

All results from a given calculation for CH₃PHCH₃ (dimethylphosphine)