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	hartrees
Energy at 0K	-418.622433
Energy at 298.15K	-418.630209
HF Energy	-418.363511
Nuclear repulsion energy	110.509598

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3196	2978	10.82
2	A'	3193	2975	21.14
3	A'	3112	2899	15.61
4	A'	2239	2086	105.96
5	A'	1586	1478	7.17
6	A'	1584	1475	15.31
7	A'	1442	1344	1.17
8	A'	1073	1000	29.30
9	A'	1033	962	38.74
10	A'	742	692	4.72
11	A'	637	594	0.84
12	A'	255	238	0.27
13	A'	181	168	0.06
14	A"	3196	2977	4.34
15	A"	3193	2975	2.13
16	A"	3111	2898	16.56
17	A"	1577	1469	13.09
18	A"	1573	1466	0.34
19	A"	1424	1326	1.18
20	A"	1073	1000	26.96
21	A"	909	847	0.80
22	A"	766	713	0.90
23	A"	684	637	7.01
24	A"	174	162	0.02

Atom	x (Å)	y (Å)	z (Å)
P1	-0.039	-0.693	0.000
H2	1.380	-0.964	0.000
C3	-0.039	0.553	1.459
C4	-0.039	0.553	-1.459
H5	-1.032	1.002	1.533
H6	-1.032	1.002	-1.533
H7	0.171	0.016	2.386
H8	0.171	0.016	-2.386
H9	0.704	1.341	1.317
H10	0.704	1.341	-1.317

	P1	H2	C3	C4	H5	H6	H7	H8	H9	H10
P1		1.4454	1.9192	1.9192	2.4914	2.4914	2.4981	2.4981	2.5347	2.5347
H2	1.4454		2.5394	2.5394	3.4692	3.4692	2.8487	2.8487	2.7398	2.7398
C3	1.9192	2.5394		2.9186	1.0919	3.1843	1.0918	3.8884	1.0922	2.9802
C4	1.9192	2.5394	2.9186		3.1843	1.0919	3.8884	1.0918	2.9802	1.0922
H5	2.4914	3.4692	1.0919	3.1843		3.0656	1.7745	4.2164	1.7822	3.3544
H6	2.4914	3.4692	3.1843	1.0919	3.0656		4.2164	1.7745	3.3544	1.7822
H7	2.4981	2.8487	1.0918	3.8884	1.7745	4.2164		4.7721	1.7836	3.9689
H8	2.4981	2.8487	3.8884	1.0918	4.2164	1.7745	4.7721		3.9689	1.7836
H9	2.5347	2.7398	1.0922	2.9802	1.7822	3.3544	1.7836	3.9689		2.6343
H10	2.5347	2.7398	2.9802	1.0922	3.3544	1.7822	3.9689	1.7836	2.6343

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C3	H5	108.526	P1	C3	H7	109.009
P1	C3	H9	111.676	P1	C4	H6	108.526
P1	C4	H8	109.009	P1	C4	H10	111.676
H2	P1	C3	97.001	H2	P1	C4	97.001
C3	P1	C4	98.995	H5	C3	H7	108.698
H5	C3	H9	109.374	H6	C4	H8	108.698
H6	C4	H10	109.374	H7	C3	H9	109.503
H8	C4	H10	109.503

All results from a given calculation for CH₃PHCH₃ (dimethylphosphine)

using model chemistry: CID/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: CID/3-21G

States and conformations

All results from a given calculation for CH₃PHCH₃ (dimethylphosphine)