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	hartrees
Energy at 0K	-421.076028
Energy at 298.15K	-421.083725
HF Energy	-420.552711
Nuclear repulsion energy	112.004631

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3128	3050
2	A'	3119	3042
3	A'	3024	2949
4	A'	2385	2326
5	A'	1460	1423
6	A'	1455	1419
7	A'	1310	1277
8	A'	999	974
9	A'	953	929
10	A'	714	696
11	A'	655	639
12	A'	253	246
13	A'	191	186
14	A"	3128	3051
15	A"	3120	3043
16	A"	3027	2952
17	A"	1448	1412
18	A"	1444	1408
19	A"	1292	1260
20	A"	1015	990
21	A"	821	801
22	A"	716	698
23	A"	696	678
24	A"	173	168

Atom	x (Å)	y (Å)	z (Å)
P1	-0.038	-0.682	0.000
H2	1.371	-0.945	0.000
C3	-0.038	0.540	1.424
C4	-0.038	0.540	-1.424
H5	-1.037	1.008	1.485
H6	-1.037	1.008	-1.485
H7	0.144	0.007	2.373
H8	0.144	0.007	-2.373
H9	0.721	1.332	1.301
H10	0.721	1.332	-1.301

	P1	H2	C3	C4	H5	H6	H7	H8	H9	H10
P1		1.4330	1.8765	1.8765	2.4610	2.4610	2.4773	2.4773	2.5151	2.5151
H2	1.4330		2.4934	2.4934	3.4368	3.4368	2.8356	2.8356	2.7019	2.7019
C3	1.8765	2.4934		2.8476	1.1043	3.1105	1.1034	3.8379	1.1037	2.9371
C4	1.8765	2.4934	2.8476		3.1105	1.1043	3.8379	1.1034	2.9371	1.1037
H5	2.4610	3.4368	1.1043	3.1105		2.9694	1.7840	4.1561	1.7965	3.3095
H6	2.4610	3.4368	3.1105	1.1043	2.9694		4.1561	1.7840	3.3095	1.7965
H7	2.4773	2.8356	1.1034	3.8379	1.7840	4.1561		4.7452	1.7995	3.9476
H8	2.4773	2.8356	3.8379	1.1034	4.1561	1.7840	4.7452		3.9476	1.7995
H9	2.5151	2.7019	1.1037	2.9371	1.7965	3.3095	1.7995	3.9476		2.6016
H10	2.5151	2.7019	2.9371	1.1037	3.3095	1.7965	3.9476	1.7995	2.6016

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C3	H5	108.514	P1	C3	H7	109.736
P1	C3	H9	112.517	P1	C4	H6	108.514
P1	C4	H8	109.736	P1	C4	H10	112.517
H2	P1	C3	96.861	H2	P1	C4	96.861
C3	P1	C4	98.709	H5	C3	H7	107.818
H5	C3	H9	108.908	H6	C4	H8	107.818
H6	C4	H10	108.908	H7	C3	H9	109.231
H8	C4	H10	109.231

All results from a given calculation for CH₃PHCH₃ (dimethylphosphine)

using model chemistry: MP4=FULL/aug-cc-pVDZ

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: MP4=FULL/aug-cc-pVDZ

States and conformations

All results from a given calculation for CH₃PHCH₃ (dimethylphosphine)