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	hartrees
Energy at 0K	-409.582877
Energy at 298.15K	-409.592260
HF Energy	-409.582877
Nuclear repulsion energy	174.204577

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3048	3011	26.83
2	A₁	2971	2935	3.16
3	A₁	2116	2091	145.20
4	A₁	1422	1405	9.18
5	A₁	1242	1227	5.17
6	A₁	842	832	57.38
7	A₁	604	597	1.49
8	A₁	231	228	0.97
9	A₂	3053	3016	0.00
10	A₂	1400	1383	0.00
11	A₂	657	649	0.00
12	A₂	135	133	0.00
13	E	3054	3017	15.62
13	E	3054	3017	15.62
14	E	3046	3009	1.33
14	E	3046	3009	1.33
15	E	2971	2935	7.06
15	E	2971	2935	7.06
16	E	1414	1397	2.74
16	E	1414	1397	2.74
17	E	1404	1387	0.12
17	E	1404	1387	0.12
18	E	1232	1217	30.45
18	E	1232	1217	30.44
19	E	883	872	152.28
19	E	883	872	152.28
20	E	823	813	15.49
20	E	823	813	15.50
21	E	693	685	11.53
21	E	693	685	11.52
22	E	595	588	7.76
22	E	595	588	7.76
23	E	198	195	0.62
23	E	198	195	0.62
24	E	147	145	0.00
24	E	147	145	0.00

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.327
H2	0.000	0.000	1.841
C3	0.000	1.545	-0.200
C4	1.338	-0.773	-0.200
C5	-1.338	-0.773	-0.200
H6	0.000	1.559	-1.243
H7	1.350	-0.780	-1.243
H8	-1.350	-0.780	-1.243
H9	-0.855	2.045	0.151
H10	0.855	2.045	0.151
H11	2.198	-0.282	0.151
H12	1.343	-1.763	0.151
H13	-1.343	-1.763	0.151
H14	-2.198	-0.282	0.151

	Si1	H2	C3	C4	C5	H6	H7	H8	H9	H10	H11	H12	H13	H14
Si1		1.5141	1.6323	1.6323	1.6323	2.2126	2.2126	2.2126	2.2234	2.2234	2.2234	2.2234	2.2234	2.2234
H2	1.5141		2.5593	2.5593	2.5593	3.4558	3.4558	3.4558	2.7870	2.7870	2.7870	2.7870	2.7870	2.7870
C3	1.6323	2.5593		2.6762	2.6762	1.0439	2.8839	2.8839	1.0506	1.0506	2.8800	3.5876	3.5876	2.8800
C4	1.6323	2.5593	2.6762		2.6762	2.8839	1.0439	2.8839	3.5876	2.8800	1.0506	1.0506	2.8800	3.5876
C5	1.6323	2.5593	2.6762	2.6762		2.8839	2.8839	1.0439	2.8800	3.5876	3.5876	2.8800	1.0506	1.0506
H6	2.2126	3.4558	1.0439	2.8839	2.8839		2.7006	2.7006	1.7063	1.7063	3.1887	3.8452	3.8452	3.1887
H7	2.2126	3.4558	2.8839	1.0439	2.8839	2.7006		2.7006	3.8452	3.1887	1.7063	1.7063	3.1887	3.8452
H8	2.2126	3.4558	2.8839	2.8839	1.0439	2.7006	2.7006		3.1887	3.8452	3.8452	3.1887	1.7063	1.7063
H9	2.2234	2.7870	1.0506	3.5876	2.8800	1.7063	3.8452	3.1887		1.7099	3.8390	4.3968	3.8390	2.6869
H10	2.2234	2.7870	1.0506	2.8800	3.5876	1.7063	3.1887	3.8452	1.7099		2.6869	3.8390	4.3968	3.8390
H11	2.2234	2.7870	2.8800	1.0506	3.5876	3.1887	1.7063	3.8452	3.8390	2.6869		1.7099	3.8390	4.3968
H12	2.2234	2.7870	3.5876	1.0506	2.8800	3.8452	1.7063	3.1887	4.3968	3.8390	1.7099		2.6869	3.8390
H13	2.2234	2.7870	3.5876	2.8800	1.0506	3.8452	3.1887	1.7063	3.8390	4.3968	3.8390	2.6869		1.7099
H14	2.2234	2.7870	2.8800	3.5876	1.0506	3.1887	3.8452	1.7063	2.6869	3.8390	4.3968	3.8390	1.7099

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Si1	C3	H6	109.578	Si1	C3	H9	110.044
Si1	C3	H10	110.044	Si1	C4	H7	109.577
Si1	C4	H11	110.044	Si1	C4	H12	110.044
Si1	C5	H8	109.577	Si1	C5	H13	110.044
Si1	C5	H14	110.044	H2	Si1	C3	108.806
H2	Si1	C4	108.806	H2	Si1	C5	108.806
C3	Si1	C4	110.129	C3	Si1	C5	110.129
C4	Si1	C5	110.129	H6	C3	H9	109.108
H6	C3	H10	109.108	H7	C4	H11	109.108
H7	C4	H12	109.108	H8	C5	H13	109.108
H8	C5	H14	109.108	H9	C3	H10	108.937
H11	C4	H12	108.937	H13	C5	H14	108.937

All results from a given calculation for SiH(CH₃)₃ (trimethylsilane)

using model chemistry: PBEPBE/Def2TZVPP

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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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	Si	0.347
2	H	-0.097
3	C	-0.374
4	C	-0.374
5	C	-0.374
6	H	0.094
7	H	0.094
8	H	0.094
9	H	0.098
10	H	0.098
11	H	0.098
12	H	0.098
13	H	0.098
14	H	0.098

<r²>	139.197
(<r²>)^1/2	11.798

All results from a given calculation for SiH(CH3)3 (trimethylsilane)

using model chemistry: PBEPBE/Def2TZVPP

States and conformations

All results from a given calculation for SiH(CH₃)₃ (trimethylsilane)