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	hartrees
Energy at 0K	-2801.027383
Energy at 298.15K
HF Energy	-2801.027383
Nuclear repulsion energy	474.538142

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	765	731	62.98	13.37	0.00	0.01
2	A₁	570	545	0.90	10.58	0.47	0.64
3	A₁	367	350	29.60	1.24	0.40	0.57
4	A₁	168	160	1.19	0.44	0.70	0.83
5	A₂	369	352	0.00	1.48	0.75	0.86
6	B₁	745	711	120.68	4.81	0.75	0.86
7	B₁	245	234	14.06	0.01	0.75	0.86
8	B₂	618	590	376.50	0.91	0.75	0.86
9	B₂	405	387	14.00	1.07	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.323
F2	0.000	1.768	0.146
F3	0.000	-1.768	0.146
F4	1.302	0.000	-0.756
F5	-1.302	0.000	-0.756

	Se1	F2	F3	F4	F5
Se1		1.7765	1.7765	1.6916	1.6916
F2	1.7765		3.5355	2.3742	2.3742
F3	1.7765	3.5355		2.3742	2.3742
F4	1.6916	2.3742	2.3742		2.6049
F5	1.6916	2.3742	2.3742	2.6049

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Se1	F3	168.599	F2	Se1	F4	86.366
F2	Se1	F5	86.366	F3	Se1	F4	86.366
F3	Se1	F5	86.366	F4	Se1	F5	100.699

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

using model chemistry: wB97X-D/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	Se	1.146
2	F	-0.347
3	F	-0.347
4	F	-0.226
5	F	-0.226

	x	y	z	Total
	0.000	0.000	1.816	1.816
CHELPG
AIM
ESP

<r²>	125.338
(<r²>)^1/2	11.195

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

using model chemistry: wB97X-D/Def2TZVPP

States and conformations

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