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	hartrees
Energy at 0K	-454.601952
Energy at 298.15K	-454.611759
HF Energy	-454.399908
Nuclear repulsion energy	176.322791

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3532	3140	9.91
2	A₁	3354	2981	1.68
3	A₁	1747	1553	2.11
4	A₁	1601	1423	0.41
5	A₁	1130	1004	25.51
6	A₁	788	700	0.14
7	A₁	349	310	1.94
8	A₂	3542	3148	0.00
9	A₂	1743	1549	0.00
10	A₂	966	859	0.00
11	A₂	179	159	0.00
12	E	3543	3149	2.87
12	E	3543	3149	2.87
13	E	3532	3140	0.98
13	E	3532	3140	0.98
14	E	3357	2984	2.41
14	E	3357	2984	2.41
15	E	1746	1552	1.50
15	E	1746	1552	1.50
16	E	1743	1549	2.23
16	E	1743	1549	2.23
17	E	1579	1403	4.20
17	E	1579	1403	4.20
18	E	1106	983	19.53
18	E	1106	983	19.53
19	E	1006	895	0.52
19	E	1006	895	0.52
20	E	850	755	6.67
20	E	850	755	6.67
21	E	294	261	0.56
21	E	294	261	0.56
22	E	195	173	0.02
22	E	195	173	0.02

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.637
C2	0.000	1.615	-0.291
C3	1.399	-0.808	-0.291
C4	-1.399	-0.808	-0.291
H5	0.000	1.481	-1.386
H6	-0.889	2.210	-0.025
H7	0.889	2.210	-0.025
H8	1.283	-0.741	-1.386
H9	2.358	-0.335	-0.025
H10	1.470	-1.875	-0.025
H11	-1.283	-0.741	-1.386
H12	-1.470	-1.875	-0.025
H13	-2.358	-0.335	-0.025

	P1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13
P1		1.8630	1.8630	1.8630	2.5077	2.4721	2.4721	2.5077	2.4721	2.4721	2.5077	2.4721	2.4721
C2	1.8630		2.7976	2.7976	1.1031	1.1020	1.1020	2.8975	3.0720	3.7959	2.8975	3.7959	3.0720
C3	1.8630	2.7976		2.7977	2.8975	3.7959	3.0720	1.1031	1.1020	1.1020	2.8975	3.0720	3.7959
C4	1.8630	2.7976	2.7977		2.8975	3.0720	3.7959	2.8975	3.7959	3.0720	1.1031	1.1020	1.1020
H5	2.5077	1.1031	2.8975	2.8975		1.7816	1.7816	2.5660	3.2735	3.9085	2.5660	3.9085	3.2735
H6	2.4721	1.1020	3.7959	3.0720	1.7816		1.7772	3.9085	4.1256	4.7163	3.2735	4.1256	2.9392
H7	2.4721	1.1020	3.0720	3.7959	1.7816	1.7772		3.2735	2.9392	4.1256	3.9085	4.7163	4.1256
H8	2.5077	2.8975	1.1031	2.8975	2.5660	3.9085	3.2735		1.7816	1.7816	2.5660	3.2735	3.9085
H9	2.4721	3.0720	1.1020	3.7959	3.2735	4.1256	2.9392	1.7816		1.7772	3.9085	4.1256	4.7163
H10	2.4721	3.7959	1.1020	3.0720	3.9085	4.7163	4.1256	1.7816	1.7772		3.2735	2.9392	4.1256
H11	2.5077	2.8975	2.8975	1.1031	2.5660	3.2735	3.9085	2.5660	3.9085	3.2735		1.7816	1.7816
H12	2.4721	3.7959	3.0720	1.1020	3.9085	4.1256	4.7163	3.2735	4.1256	2.9392	1.7816		1.7772
H13	2.4721	3.0720	3.7959	1.1020	3.2735	2.9392	4.1256	3.9085	4.7163	4.1256	1.7816	1.7772

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H5	112.923	P1	C2	H6	110.325
P1	C2	H7	110.325	P1	C3	H8	112.923
P1	C3	H9	110.325	P1	C3	H10	110.325
P1	C4	H11	112.923	P1	C4	H12	110.325
P1	C4	H13	110.325	C2	P1	C3	97.329
C2	P1	C4	97.329	C3	P1	C4	97.329
H5	C2	H6	107.794	H5	C2	H7	107.794
H6	C2	H7	107.481	H8	C3	H9	107.794
H8	C3	H10	107.794	H9	C3	H10	107.482
H11	C4	H12	107.794	H11	C4	H13	107.794
H12	C4	H13	107.482

All results from a given calculation for P(CH₃)₃ (trimethylphosphine)

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

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 P(CH3)3 (trimethylphosphine)

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

States and conformations

All results from a given calculation for P(CH₃)₃ (trimethylphosphine)