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	hartrees
Energy at 0K	-460.437272
Energy at 298.15K	-460.447063
HF Energy	-459.646498
Nuclear repulsion energy	178.620219

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3159	2999	26.57
2	A₁	3074	2918	24.14
3	A₁	1503	1427	10.46
4	A₁	1341	1273	7.56
5	A₁	974	924	21.61
6	A₁	683	648	0.37
7	A₁	295	280	0.61
8	A₂	3172	3012	0.00
9	A₂	1476	1402	0.00
10	A₂	786	746	0.00
11	A₂	187	177	0.00
12	E	3172	3011	7.90
12	E	3172	3011	7.90
13	E	3160	3001	1.97
13	E	3160	3001	1.97
14	E	3078	2923	12.30
14	E	3078	2923	12.30
15	E	1494	1418	8.31
15	E	1494	1418	8.31
16	E	1483	1408	4.66
16	E	1483	1408	4.66
17	E	1317	1250	4.61
17	E	1317	1250	4.61
18	E	962	913	19.43
18	E	962	913	19.43
19	E	842	799	0.46
19	E	842	799	0.46
20	E	739	702	13.24
20	E	739	702	13.24
21	E	257	244	0.21
21	E	257	244	0.21
22	E	214	203	0.00
22	E	214	203	0.00

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.611
C2	0.000	1.607	-0.282
C3	1.392	-0.804	-0.282
C4	-1.392	-0.804	-0.282
H5	0.000	1.464	-1.360
H6	-0.877	2.181	-0.000
H7	0.877	2.181	-0.000
H8	1.268	-0.732	-1.360
H9	2.327	-0.331	-0.000
H10	1.450	-1.850	-0.000
H11	-1.268	-0.732	-1.360
H12	-1.450	-1.850	-0.000
H13	-2.327	-0.331	-0.000

	P1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13
P1		1.8386	1.8386	1.8386	2.4551	2.4289	2.4289	2.4551	2.4289	2.4289	2.4551	2.4289	2.4289
C2	1.8386		2.7839	2.7839	1.0873	1.0853	1.0853	2.8710	3.0418	3.7598	2.8710	3.7598	3.0418
C3	1.8386	2.7839		2.7839	2.8710	3.7598	3.0418	1.0873	1.0853	1.0853	2.8710	3.0418	3.7598
C4	1.8386	2.7839	2.7839		2.8710	3.0418	3.7598	2.8710	3.7598	3.0418	1.0873	1.0853	1.0853
H5	2.4551	1.0873	2.8710	2.8710		1.7695	1.7695	2.5362	3.2384	3.8648	2.5362	3.8648	3.2384
H6	2.4289	1.0853	3.7598	3.0418	1.7695		1.7544	3.8648	4.0717	4.6548	3.2384	4.0717	2.9004
H7	2.4289	1.0853	3.0418	3.7598	1.7695	1.7544		3.2384	2.9004	4.0717	3.8648	4.6548	4.0717
H8	2.4551	2.8710	1.0873	2.8710	2.5362	3.8648	3.2384		1.7695	1.7695	2.5362	3.2384	3.8648
H9	2.4289	3.0418	1.0853	3.7598	3.2384	4.0717	2.9004	1.7695		1.7544	3.8648	4.0717	4.6548
H10	2.4289	3.7598	1.0853	3.0418	3.8648	4.6548	4.0717	1.7695	1.7544		3.2384	2.9004	4.0717
H11	2.4551	2.8710	2.8710	1.0873	2.5362	3.2384	3.8648	2.5362	3.8648	3.2384		1.7695	1.7695
H12	2.4289	3.7598	3.0418	1.0853	3.8648	4.0717	4.6548	3.2384	4.0717	2.9004	1.7695		1.7544
H13	2.4289	3.0418	3.7598	1.0853	3.2384	2.9004	4.0717	3.8648	4.6548	4.0717	1.7695	1.7544

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H5	111.491	P1	C2	H6	109.640
P1	C2	H7	109.640	P1	C3	H8	111.491
P1	C3	H9	109.640	P1	C3	H10	109.640
P1	C4	H11	111.491	P1	C4	H12	109.640
P1	C4	H13	109.640	C2	P1	C3	98.415
C2	P1	C4	98.415	C3	P1	C4	98.415
H5	C2	H6	109.071	H5	C2	H7	109.071
H6	C2	H7	107.851	H8	C3	H9	109.071
H8	C3	H10	109.071	H9	C3	H10	107.851
H11	C4	H12	109.071	H11	C4	H13	109.071
H12	C4	H13	107.851

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

using model chemistry: MP2=FULL/cc-pVTZ

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/cc-pVTZ

States and conformations

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