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	hartrees
Energy at 0K	-421.533159
Energy at 298.15K	-421.540916
HF Energy	-421.388691
Nuclear repulsion energy	112.812426

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3169	3014	14.09
2	A'	3163	3008	27.64
3	A'	3075	2924	21.87
4	A'	2426	2307	117.04
5	A'	1503	1429	6.47
6	A'	1499	1425	14.08
7	A'	1370	1303	1.72
8	A'	1034	983	31.75
9	A'	986	938	32.48
10	A'	730	695	3.01
11	A'	668	635	2.95
12	A'	256	244	0.47
13	A'	191	182	0.11
14	A"	3170	3014	6.80
15	A"	3165	3010	0.39
16	A"	3077	2926	22.51
17	A"	1494	1421	9.74
18	A"	1487	1414	2.90
19	A"	1353	1287	2.57
20	A"	1046	994	29.51
21	A"	850	809	0.21
22	A"	736	700	2.08
23	A"	716	681	14.70
24	A"	177	169	0.03

Atom	x (Å)	y (Å)	z (Å)
P1	-0.038	-0.667	0.000
H2	1.353	-0.943	0.000
C3	-0.038	0.529	1.427
C4	-0.038	0.529	-1.427
H5	-1.027	0.982	1.512
H6	-1.027	0.982	-1.512
H7	0.158	-0.011	2.355
H8	0.158	-0.011	-2.355
H9	0.703	1.324	1.319
H10	0.703	1.324	-1.319

	P1	H2	C3	C4	H5	H6	H7	H8	H9	H10
P1		1.4176	1.8615	1.8615	2.4461	2.4461	2.4519	2.4519	2.5004	2.5004
H2	1.4176		2.4769	2.4769	3.4140	3.4140	2.8001	2.8001	2.7019	2.7019
C3	1.8615	2.4769		2.8532	1.0916	3.1334	1.0913	3.8246	1.0917	2.9532
C4	1.8615	2.4769	2.8532		3.1334	1.0916	3.8246	1.0913	2.9532	1.0917
H5	2.4461	3.4140	1.0916	3.1334		3.0234	1.7609	4.1639	1.7741	3.3356
H6	2.4461	3.4140	3.1334	1.0916	3.0234		4.1639	1.7609	3.3356	1.7741
H7	2.4519	2.8001	1.0913	3.8246	1.7609	4.1639		4.7091	1.7751	3.9469
H8	2.4519	2.8001	3.8246	1.0913	4.1639	1.7609	4.7091		3.9469	1.7751
H9	2.5004	2.7019	1.0917	2.9532	1.7741	3.3356	1.7751	3.9469		2.6389
H10	2.5004	2.7019	2.9532	1.0917	3.3356	1.7741	3.9469	1.7751	2.6389

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C3	H5	109.050	P1	C3	H7	109.490
P1	C3	H9	113.104	P1	C4	H6	109.050
P1	C4	H8	109.490	P1	C4	H10	113.104
H2	P1	C3	97.185	H2	P1	C4	97.185
C3	P1	C4	100.057	H5	C3	H7	107.544
H5	C3	H9	108.697	H6	C4	H8	107.544
H6	C4	H10	108.697	H7	C3	H9	108.803
H8	C4	H10	108.803

All results from a given calculation for CH₃PHCH₃ (dimethylphosphine)

using model chemistry: B2PLYP=FULL/6-31+G**

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: B2PLYP=FULL/6-31+G**

States and conformations

All results from a given calculation for CH₃PHCH₃ (dimethylphosphine)