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	hartrees
Energy at 0K	-2798.771460
Energy at 298.15K
HF Energy	-2798.771460
Nuclear repulsion energy	465.658996

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	735	707	60.54	15.42	0.00	0.01
2	A₁	557	536	1.24	15.43	0.43	0.60
3	A₁	338	325	24.41	1.43	0.31	0.48
4	A₁	173	167	2.99	0.55	0.55	0.71
5	A₂	331	319	0.00	1.57	0.75	0.86
6	B₁	718	691	109.26	5.69	0.75	0.86
7	B₁	209	201	13.57	0.06	0.75	0.86
8	B₂	594	572	385.60	0.54	0.75	0.86
9	B₂	376	362	6.75	1.04	0.75	0.86

Atom	x (Å)	y (Å)	z (Å)
Se1	0.000	0.000	0.320
F2	0.000	1.810	0.200
F3	0.000	-1.810	0.200
F4	1.299	0.000	-0.804
F5	-1.299	0.000	-0.804

	Se1	F2	F3	F4	F5
Se1		1.8139	1.8139	1.7172	1.7172
F2	1.8139		3.6198	2.4432	2.4432
F3	1.8139	3.6198		2.4432	2.4432
F4	1.7172	2.4432	2.4432		2.5977
F5	1.7172	2.4432	2.4432	2.5977

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
F2	Se1	F3	172.412	F2	Se1	F4	87.519
F2	Se1	F5	87.519	F3	Se1	F4	87.519
F3	Se1	F5	87.519	F4	Se1	F5	98.293

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

using model chemistry: B3LYPultrafine/6-31+G**

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	1.561
2	F	-0.417
3	F	-0.417
4	F	-0.364
5	F	-0.364

	x	y	z	Total
	0.000	0.000	1.874	1.874
CHELPG
AIM
ESP

<r²>	130.113
(<r²>)^1/2	11.407

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

using model chemistry: B3LYPultrafine/6-31+G**

States and conformations

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