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	hartrees
Energy at 0K	-420.942492
Energy at 298.15K	-420.950295
HF Energy	-420.525288
Nuclear repulsion energy	112.664642

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3156	3006	15.78
2	A'	3152	3001	30.28
3	A'	3067	2921	16.37
4	A'	2401	2286	116.34
5	A'	1529	1456	1.53
6	A'	1528	1456	14.33
7	A'	1407	1340	1.38
8	A'	1051	1001	35.53
9	A'	1011	963	33.96
10	A'	738	703	2.90
11	A'	684	652	2.24
12	A'	265	253	0.29
13	A'	194	184	0.10
14	A"	3156	3006	8.82
15	A"	3152	3002	0.09
16	A"	3068	2922	17.55
17	A"	1521	1449	8.22
18	A"	1515	1443	2.31
19	A"	1391	1324	2.00
20	A"	1052	1002	29.66
21	A"	875	833	0.89
22	A"	742	707	4.07
23	A"	731	696	9.96
24	A"	182	174	0.02

Atom	x (Å)	y (Å)	z (Å)
P1	-0.038	-0.669	0.000
H2	1.360	-0.953	0.000
C3	-0.038	0.531	1.423
C4	-0.038	0.531	-1.423
H5	-1.029	0.992	1.505
H6	-1.029	0.992	-1.505
H7	0.156	-0.005	2.360
H8	0.156	-0.005	-2.360
H9	0.708	1.326	1.313
H10	0.708	1.326	-1.313

	P1	H2	C3	C4	H5	H6	H7	H8	H9	H10
P1		1.4269	1.8617	1.8617	2.4514	2.4514	2.4592	2.4592	2.5028	2.5028
H2	1.4269		2.4866	2.4866	3.4295	3.4295	2.8139	2.8139	2.7106	2.7106
C3	1.8617	2.4866		2.8464	1.0966	3.1258	1.0962	3.8256	1.0963	2.9456
C4	1.8617	2.4866	2.8464		3.1258	1.0966	3.8256	1.0962	2.9456	1.0963
H5	2.4514	3.4295	1.0966	3.1258		3.0103	1.7692	4.1638	1.7795	3.3274
H6	2.4514	3.4295	3.1258	1.0966	3.0103		4.1638	1.7692	3.3274	1.7795
H7	2.4592	2.8139	1.0962	3.8256	1.7692	4.1638		4.7195	1.7811	3.9453
H8	2.4592	2.8139	3.8256	1.0962	4.1638	1.7692	4.7195		3.9453	1.7811
H9	2.5028	2.7106	1.0963	2.9456	1.7795	3.3274	1.7811	3.9453		2.6259
H10	2.5028	2.7106	2.9456	1.0963	3.3274	1.7795	3.9453	1.7811	2.6259

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C3	H5	109.176	P1	C3	H7	109.770
P1	C3	H9	113.023	P1	C4	H6	109.176
P1	C4	H8	109.770	P1	C4	H10	113.023
H2	P1	C3	97.370	H2	P1	C4	97.370
C3	P1	C4	99.721	H5	C3	H7	107.579
H5	C3	H9	108.486	H6	C4	H8	107.579
H6	C4	H10	108.486	H7	C3	H9	108.655
H8	C4	H10	108.655

All results from a given calculation for CH₃PHCH₃ (dimethylphosphine)

using model chemistry: QCISD/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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All results from a given calculation for CH3PHCH3 (dimethylphosphine)

using model chemistry: QCISD/6-31G*

States and conformations

All results from a given calculation for CH₃PHCH₃ (dimethylphosphine)