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	hartrees
Energy at 0K	-28.537636
Energy at 298.15K	-28.547284
HF Energy	-28.054709
Nuclear repulsion energy	71.125974

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3180	3019	52.67
2	A₁	3072	2917	23.82
3	A₁	1512	1435	11.87
4	A₁	1378	1309	4.26
5	A₁	1003	952	44.46
6	A₁	668	635	0.15
7	A₁	294	279	0.47
8	A₂	3191	3030	0.00
9	A₂	1490	1414	0.00
10	A₂	808	767	0.00
11	A₂	149	142	0.00
12	E	3192	3030	20.92
12	E	3192	3030	20.92
13	E	3181	3020	4.87
13	E	3181	3020	4.87
14	E	3075	2920	23.11
14	E	3075	2920	23.11
15	E	1504	1428	10.86
15	E	1504	1428	10.86
16	E	1493	1418	5.60
16	E	1493	1418	5.60
17	E	1354	1285	4.63
17	E	1354	1285	4.63
18	E	985	935	22.82
18	E	985	935	22.82
19	E	867	823	0.75
19	E	867	823	0.75
20	E	728	691	8.94
20	E	728	691	8.94
21	E	249	237	0.10
21	E	249	237	0.10
22	E	204	193	0.02
22	E	204	193	0.02

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.621
C2	0.000	1.640	-0.288
C3	1.420	-0.820	-0.288
C4	-1.420	-0.820	-0.288
H5	0.000	1.503	-1.385
H6	-0.893	2.219	0.004
H7	0.893	2.219	0.004
H8	1.302	-0.752	-1.385
H9	2.369	-0.336	0.004
H10	1.475	-1.883	0.004
H11	-1.302	-0.752	-1.385
H12	-1.475	-1.883	0.004
H13	-2.369	-0.336	0.004

	P1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13
P1		1.8745	1.8745	1.8745	2.5066	2.4705	2.4705	2.5066	2.4705	2.4705	2.5066	2.4705	2.4705
C2	1.8745		2.8401	2.8401	1.1056	1.1043	1.1043	2.9357	3.0982	3.8306	2.9357	3.8306	3.0982
C3	1.8745	2.8401		2.8401	2.9357	3.8306	3.0981	1.1056	1.1043	1.1043	2.9357	3.0982	3.8306
C4	1.8745	2.8401	2.8401		2.9357	3.0981	3.8306	2.9357	3.8306	3.0982	1.1056	1.1043	1.1043
H5	2.5066	1.1056	2.9357	2.9357		1.8002	1.8002	2.6041	3.3051	3.9468	2.6041	3.9468	3.3051
H6	2.4705	1.1043	3.8306	3.0981	1.8002		1.7870	3.9468	4.1436	4.7373	3.3051	4.1436	2.9503
H7	2.4705	1.1043	3.0981	3.8306	1.8002	1.7870		3.3051	2.9503	4.1436	3.9468	4.7373	4.1436
H8	2.5066	2.9357	1.1056	2.9357	2.6041	3.9468	3.3051		1.8002	1.8002	2.6041	3.3051	3.9468
H9	2.4705	3.0982	1.1043	3.8306	3.3051	4.1436	2.9503	1.8002		1.7870	3.9468	4.1436	4.7373
H10	2.4705	3.8306	1.1043	3.0982	3.9468	4.7373	4.1436	1.8002	1.7870		3.3051	2.9503	4.1436
H11	2.5066	2.9357	2.9357	1.1056	2.6041	3.3051	3.9468	2.6041	3.9468	3.3051		1.8002	1.8002
H12	2.4705	3.8306	3.0982	1.1043	3.9468	4.1436	4.7373	3.3051	4.1436	2.9503	1.8002		1.7870
H13	2.4705	3.0982	3.8306	1.1043	3.3051	2.9503	4.1436	3.9468	4.7373	4.1436	1.8002	1.7870

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H5	111.909	P1	C2	H6	109.322
P1	C2	H7	109.322	P1	C3	H8	111.909
P1	C3	H9	109.322	P1	C3	H10	109.322
P1	C4	H11	111.909	P1	C4	H12	109.322
P1	C4	H13	109.322	C2	P1	C3	98.496
C2	P1	C4	98.496	C3	P1	C4	98.496
H5	C2	H6	109.095	H5	C2	H7	109.095
H6	C2	H7	108.017	H8	C3	H9	109.095
H8	C3	H10	109.095	H9	C3	H10	108.017
H11	C4	H12	109.095	H11	C4	H13	109.095
H12	C4	H13	108.017

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

using model chemistry: MP2/CEP-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 P(CH3)3 (trimethylphosphine)

using model chemistry: MP2/CEP-31G*

States and conformations

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