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	hartrees
Energy at 0K	-421.000962
Energy at 298.15K	-421.008759
HF Energy	-420.559742
Nuclear repulsion energy	112.874464

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3123	2990	16.95
2	A'	3119	2987	30.15
3	A'	3037	2908	20.24
4	A'	2330	2231	101.02
5	A'	1511	1447	5.01
6	A'	1509	1445	15.00
7	A'	1396	1336	2.14
8	A'	1044	999	46.10
9	A'	1002	959	39.30
10	A'	736	704	3.25
11	A'	683	654	3.04
12	A'	269	258	0.59
13	A'	191	182	0.19
14	A"	3123	2990	9.38
15	A"	3120	2987	0.03
16	A"	3038	2909	21.23
17	A"	1501	1437	11.01
18	A"	1495	1431	1.02
19	A"	1377	1319	4.70
20	A"	1049	1004	30.66
21	A"	865	828	0.75
22	A"	739	708	4.76
23	A"	726	695	11.31
24	A"	174	167	0.01

Atom	x (Å)	y (Å)	z (Å)
P1	-0.038	-0.670	0.000
H2	1.364	-0.937	0.000
C3	-0.038	0.530	1.418
C4	-0.038	0.530	-1.418
H5	-1.029	0.991	1.505
H6	-1.029	0.991	-1.505
H7	0.157	-0.003	2.355
H8	0.157	-0.003	-2.355
H9	0.706	1.326	1.308
H10	0.706	1.326	-1.308

	P1	H2	C3	C4	H5	H6	H7	H8	H9	H10
P1		1.4275	1.8575	1.8575	2.4500	2.4500	2.4552	2.4552	2.4996	2.4996
H2	1.4275		2.4759	2.4759	3.4214	3.4214	2.8059	2.8059	2.6953	2.6953
C3	1.8575	2.4759		2.8357	1.0957	3.1199	1.0954	3.8150	1.0954	2.9354
C4	1.8575	2.4759	2.8357		3.1199	1.0957	3.8150	1.0954	2.9354	1.0954
H5	2.4500	3.4214	1.0957	3.1199		3.0092	1.7654	4.1578	1.7779	3.3213
H6	2.4500	3.4214	3.1199	1.0957	3.0092		4.1578	1.7654	3.3213	1.7779
H7	2.4552	2.8059	1.0954	3.8150	1.7654	4.1578		4.7093	1.7784	3.9344
H8	2.4552	2.8059	3.8150	1.0954	4.1578	1.7654	4.7093		3.9344	1.7784
H9	2.4996	2.6953	1.0954	2.9354	1.7779	3.3213	1.7784	3.9344		2.6154
H10	2.4996	2.6953	2.9354	1.0954	3.3213	1.7779	3.9344	1.7784	2.6154

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
P1	C3	H5	109.396	P1	C3	H7	109.787
P1	C3	H9	113.115	P1	C4	H6	109.396
P1	C4	H8	109.787	P1	C4	H10	113.115
H2	P1	C3	96.951	H2	P1	C4	96.951
C3	P1	C4	99.513	H5	C3	H7	107.363
H5	C3	H9	108.469	H6	C4	H8	107.363
H6	C4	H10	108.469	H7	C3	H9	108.539
H8	C4	H10	108.539

All results from a given calculation for CH₃PHCH₃ (dimethylphosphine)

using model chemistry: QCISD/6-311G*

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: QCISD/6-311G*

States and conformations

All results from a given calculation for CH₃PHCH₃ (dimethylphosphine)