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	hartrees
Energy at 0K	-2786.564205
Energy at 298.15K
HF Energy	-2786.564205
Nuclear repulsion energy	459.815238

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	655	649	21.50	12.83	0.00	0.01
2	A₁	545	540	0.13	10.49	0.49	0.66
3	A₁	301	299	26.74	1.47	0.57	0.72
4	A₁	118	117	1.02	0.77	0.67	0.81
5	A₂	287	284	0.00	2.61	0.75	0.86
6	B₁	665	659	50.89	4.99	0.75	0.86
7	B₁	187	185	11.65	0.02	0.75	0.86
8	B₂	631	625	137.77	0.98	0.75	0.86
9	B₂	319	316	10.14	1.58	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.343
F2	0.000	1.799	0.105
F3	0.000	-1.799	0.105
F4	1.384	0.000	-0.754
F5	-1.384	0.000	-0.754

	Se1	F2	F3	F4	F5
Se1		1.8151	1.8151	1.7662	1.7662
F2	1.8151		3.5989	2.4274	2.4274
F3	1.8151	3.5989		2.4274	2.4274
F4	1.7662	2.4274	2.4274		2.7683
F5	1.7662	2.4274	2.4274	2.7683

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Se1	F3	164.945	F2	Se1	F4	85.332
F2	Se1	F5	85.332	F3	Se1	F4	85.332
F3	Se1	F5	85.332	F4	Se1	F5	103.199

All results from a given calculation for SeF₄ (Selenium tetrafluoride)

using model chemistry: PBEPBE/3-21G

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	Se	1.421
2	F	-0.381
3	F	-0.381
4	F	-0.330
5	F	-0.330

	x	y	z	Total
	0.000	0.000	2.228	2.228
CHELPG
AIM
ESP

<r²>	131.088
(<r²>)^1/2	11.449

All results from a given calculation for SeF4 (Selenium tetrafluoride)

using model chemistry: PBEPBE/3-21G

States and conformations

All results from a given calculation for SeF₄ (Selenium tetrafluoride)