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	hartrees
Energy at 0K	-460.041751
Energy at 298.15K	-460.051630
HF Energy	-459.567188
Nuclear repulsion energy	177.189602

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3228	2981	39.76
2	A₁	3143	2903	21.44
3	A₁	1573	1453	9.92
4	A₁	1450	1339	3.80
5	A₁	1048	968	45.00
6	A₁	693	640	0.45
7	A₁	303	280	0.38
8	A₂	3239	2992	0.00
9	A₂	1550	1432	0.00
10	A₂	849	784	0.00
11	A₂	183	169	0.00
12	E	3240	2992	16.18
12	E	3240	2992	16.18
13	E	3227	2981	3.78
13	E	3227	2981	3.78
14	E	3142	2902	15.30
14	E	3142	2902	15.30
15	E	1565	1446	10.78
15	E	1565	1446	10.78
16	E	1554	1435	5.11
16	E	1554	1435	5.11
17	E	1427	1318	6.49
17	E	1427	1318	6.49
18	E	1027	949	24.96
18	E	1027	949	24.96
19	E	904	835	0.24
19	E	904	835	0.24
20	E	756	698	11.86
20	E	756	698	11.86
21	E	260	240	0.17
21	E	260	240	0.17
22	E	212	196	0.01
22	E	212	196	0.01

Atom	x (Å)	y (Å)	z (Å)
P1	0.000	0.000	0.596
C2	0.000	1.631	-0.275
C3	1.412	-0.815	-0.275
C4	-1.412	-0.815	-0.275
H5	0.000	1.523	-1.361
H6	-0.879	2.205	0.016
H7	0.879	2.205	0.016
H8	1.319	-0.762	-1.361
H9	2.349	-0.341	0.016
H10	1.470	-1.864	0.016
H11	-1.319	-0.762	-1.361
H12	-1.470	-1.864	0.016
H13	-2.349	-0.341	0.016

	P1	C2	C3	C4	H5	H6	H7	H8	H9	H10	H11	H12	H13
P1		1.8491	1.8491	1.8491	2.4805	2.4437	2.4437	2.4805	2.4437	2.4437	2.4805	2.4437	2.4437
C2	1.8491		2.8246	2.8246	1.0913	1.0898	1.0898	2.9400	3.0807	3.8024	2.9400	3.8024	3.0807
C3	1.8491	2.8246		2.8246	2.9400	3.8024	3.0807	1.0913	1.0898	1.0898	2.9400	3.0807	3.8024
C4	1.8491	2.8246	2.8246		2.9400	3.0807	3.8024	2.9400	3.8024	3.0807	1.0913	1.0898	1.0898
H5	2.4805	1.0913	2.9400	2.9400		1.7705	1.7705	2.6385	3.3001	3.9410	2.6385	3.9410	3.3001
H6	2.4437	1.0898	3.8024	3.0807	1.7705		1.7587	3.9410	4.1115	4.6983	3.3001	4.1115	2.9396
H7	2.4437	1.0898	3.0807	3.8024	1.7705	1.7587		3.3001	2.9396	4.1115	3.9410	4.6983	4.1115
H8	2.4805	2.9400	1.0913	2.9400	2.6385	3.9410	3.3001		1.7705	1.7705	2.6385	3.3001	3.9410
H9	2.4437	3.0807	1.0898	3.8024	3.3001	4.1115	2.9396	1.7705		1.7587	3.9410	4.1115	4.6983
H10	2.4437	3.8024	1.0898	3.0807	3.9410	4.6983	4.1115	1.7705	1.7587		3.3001	2.9396	4.1115
H11	2.4805	2.9400	2.9400	1.0913	2.6385	3.3001	3.9410	2.6385	3.9410	3.3001		1.7705	1.7705
H12	2.4437	3.8024	3.0807	1.0898	3.9410	4.1115	4.6983	3.3001	4.1115	2.9396	1.7705		1.7587
H13	2.4437	3.0807	3.8024	1.0898	3.3001	2.9396	4.1115	3.9410	4.6983	4.1115	1.7705	1.7587

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C2	H5	112.475	P1	C2	H6	109.793
P1	C2	H7	109.793	P1	C3	H8	112.475
P1	C3	H9	109.793	P1	C3	H10	109.793
P1	C4	H11	112.475	P1	C4	H12	109.793
P1	C4	H13	109.793	C2	P1	C3	99.596
C2	P1	C4	99.596	C3	P1	C4	99.596
H5	C2	H6	108.530	H5	C2	H7	108.530
H6	C2	H7	107.586	H8	C3	H9	108.530
H8	C3	H10	108.530	H9	C3	H10	107.586
H11	C4	H12	108.530	H11	C4	H13	108.530
H12	C4	H13	107.586

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

using model chemistry: CID/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 P(CH3)3 (trimethylphosphine)

using model chemistry: CID/6-31G*

States and conformations

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