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	hartrees
Energy at 0K	-390.162588
Energy at 298.15K
HF Energy	-390.162588
Nuclear repulsion energy	62.133694

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	2356	2139	30.42	230.85	0.05	0.09
2	A₁	1068	970	262.10	9.62	0.70	0.82
3	A₁	896	813	69.12	3.15	0.42	0.60
4	E	2353	2137	170.57	58.92	0.75	0.86
4	E	2353	2137	170.57	58.92	0.75	0.86
5	E	1028	933	128.42	16.84	0.75	0.86
5	E	1028	933	128.42	16.84	0.75	0.86
6	E	773	702	74.67	12.07	0.75	0.86
6	E	773	702	74.67	12.07	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	0.514
F2	0.000	0.000	-1.121
H3	0.000	1.407	0.966
H4	-1.219	-0.704	0.966
H5	1.219	-0.704	0.966

	Si1	F2	H3	H4	H5
Si1		1.6353	1.4783	1.4783	1.4783
F2	1.6353		2.5178	2.5178	2.5178
H3	1.4783	2.5178		2.4377	2.4377
H4	1.4783	2.5178	2.4377		2.4377
H5	1.4783	2.5178	2.4377	2.4377

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Si1	H3	107.820	F2	Si1	H4	107.820
F2	Si1	H5	107.820	H3	Si1	H4	111.071
H3	Si1	H5	111.071	H4	Si1	H5	111.071

All results from a given calculation for SiH₃F (monofluorosilane)

using model chemistry: HF/cc-pVDZ

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	0.856
2	F	-0.467
3	H	-0.130
4	H	-0.130
5	H	-0.130

	x	y	z	Total
	0.000	0.000	1.842	1.842
CHELPG
AIM
ESP

<r²>	36.457
(<r²>)^1/2	6.038

All results from a given calculation for SiH3F (monofluorosilane)

using model chemistry: HF/cc-pVDZ

States and conformations

All results from a given calculation for SiH₃F (monofluorosilane)