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Xenon trifluoride Lewis Structure

Xenon trifluoride Lewis structure (F3Xe). Xe–F single bond, Xe–F single bond and Xe–F single bond. It shows an ionic lattice with no discrete molecular geometry, sp3d2 hybridization on Xe. Includes a comparison table and FAQs. Hadley3 MIN READSeptember 30, 2026

Xenon trifluoride Lewis Structure: F3Xe Lewis Structure, see text Geometry, sp3d2 Hybridization & Polarity

Xenon trifluoride Lewis structure Cover

Xenon trifluoride Key Facts

The Xenon trifluoride Lewis structure is Xe–F single bond, Xe–F single bond and Xe–F single bond; the central Xe has 6 electron domains (2 lone pairs), giving a octahedral electron-domain arrangement and a see text molecular geometry with a — bond angle. Xe is best described as sp3d2-hybridized, and Xenon trifluoride is polar because the see text shape (and/or unequal terminal atoms) prevents cancellation of the bond dipoles.

Xenon trifluoride Lewis Structure Figure 1: Lewis Structure of Xenon trifluoride (F3Xe)
Chemical Formula F3Xe
CAS Number 13709-45-0
Total Valence Electrons 29
Lewis Structure Xe–F single bond, Xe–F single bond and Xe–F single bond
Electron-Domain Geometry octahedral
Molecular Geometry see text
Hybridization Model sp3d2 (central Xe)
Bond Angle —
Polarity Polar molecule
PubChem and NIST list Xenon trifluoride as F 3Xe with CAS 13709-45-0; molecular weight ≈ 188.29 g/mol. View CAS 13709-45-0 dictionary details on Guidechem →

Applications of Xenon trifluoride (CAS 13709-45-0)

Noble-gas compounds such as Xenon trifluoride are among the strongest known fluorinating and oxidizing agents. XeF2 is valued as a selective fluorinator and as a photoresist/oxide etchant in microelectronics, while the higher fluorides are used in fluorination and as powerful oxidizers. They react vigorously with water and organics and are handled only in passivated, rigorously dry systems.

Selective Fluorinator XeF2 in particular is used to introduce fluorine and to etch oxides in semiconductor processing.
Strong Oxidizer Higher xenon fluorides oxidize refractory metals and support specialized fluorination.
Handling Moisture- and organics-sensitive; processed in passivated, anhydrous equipment.
Procurement Note "Xenon trifluoride" is supplied in multiple commercial grades and package sizes. Specify purity, grade, moisture/impurity limits, package (cylinder, drum or bulk) and intended process, and use CAS 13709-45-0 as the primary identifier when screening suppliers; always confirm regional availability and safety documentation (SDS).

Step 1 - Valence Electrons & Central Atom

To draw the Xenon trifluoride Lewis structure we first count the total valence electrons. F3Xe contains 3×7 (F) + 8 (Xe); the net charge of 0 gives a total of 29 valence electrons to place.

The central atom is Xe. It is the least electronegative atom capable of forming multiple bonds and is surrounded by the more electronegative terminal atom(s); hydrogen, when present, always occupies a terminal position. Electronegativity considerations place the electron density toward the terminal atom(s).

Valence-electron count

Total valence electrons = 3×7 (F) + 8 (Xe) = 29 electrons.

Step 2 - Lewis Structure & Electron Distribution

Place Xe at the center and connect each surrounding atom with a single bond, complete octets on the terminal atoms, and place any remaining electrons on the central atom. The resulting electron distribution is: Xe–F single bond, Xe–F single bond and Xe–F single bond; 2 lone pairs on Xe and one unpaired electron on Xe.

Counting bonding and nonbonding electrons around Xe therefore satisfies the octet/expanded-octet requirement for the drawn structure.

Xe–F Xe–F Xe–F
Xe: 2 lone pairs, 3 bonding domains
3 bonding domains + 2 lone pairs = 6 electron domains
Expanded Octet: d-Orbital Participation Central Xe belongs to period 3 or below, so it can accommodate more than eight electrons: low-lying d orbitals become available and the see text arrangement with 6 domains reflects this expanded valence shell. The octet rule alone does not apply to such hypervalent species.

Step 3 - VSEPR Theory & Geometry

VSEPR theory states that the 6 electron domains around Xe arrange to minimize mutual repulsion, giving an octahedral electron-domain geometry.

Because 2 of these domains are lone pair(s) — and lone pairs repel more strongly than bonding pairs — the observed molecular geometry is see text; the Xe bond angle is set to — rather than the ideal value for the electron-domain geometry.

Repulsion hierarchy

A useful VSEPR approximation is: lone pair–lone pair repulsion > lone pair–bonding pair repulsion > bonding pair–bonding pair repulsion. With 2 lone pair(s) on Xe, the lone-pair domains occupy positions that minimize overall repulsion while pushing the bonding domains (and therefore the bonded atoms) closer together.

Hybridization & Formal Charge

In the conventional localized-bond model, Xe uses sp3d2 hybrid orbitals to form the 6 equivalent electron-domain directions (3 bonding + 2 lone pair).

Formal-charge check

Formal charge on central Xe = V − N − ½B = 8 − 4 − ½×6 = 1. The nonzero formal charge is distributed by resonance / charge separation; the drawn structure is the lowest-energy contributor.

Modeling Note Modeling Note: sp3d2 / sp3d2 hybridization is a convenient localized-bond teaching model. Modern quantum-chemical descriptions of hypervalent Xenon trifluoride use molecular orbitals and do not require populated d orbitals as the primary bonding picture.

Is Xenon trifluoride Polar or Nonpolar?

Xenon trifluoride is polar. The see text shape prevents cancellation of the bond dipoles. The bond dipoles do not cancel, leaving a net molecular dipole, which strongly influences solvation behavior and intermolecular interactions.

Expert Quote — Structural Chemistry Perspective

The decisive structural fact is not simply that the individual bonds are polar; it is whether molecular symmetry allows their vector sum to vanish. In Xenon trifluoride the see text arrangement prevents cancellation, so a permanent dipole remains.

Interpretation consistent with standard VSEPR / molecular-geometry references.

This polarity profile underpins its behavior as a solvent, reactant or process intermediate; when sourcing, specify grade and container compatibility.

Structural Comparison Table

Species Formula Central Atom Electron Domains Molecular Geometry Polarity
Xenon trifluoride F3Xe Xe 6 see text Polar
Xenon difluoride F2Xe Xe 5 linear Nonpolar
Xenon tetrafluoride F4Xe Xe 6 square planar Nonpolar
Xenon hexafluoride F6Xe Xe 7 distorted octahedral (seven domains) Polar
Practice question Starting from the 29 valence electrons of F3Xe, draw the Lewis structure and confirm the central Xe atom is sp3d2-hybridized with see text geometry. What happens to the bond angle if one terminal atom is replaced by a more electronegative substituent?
Looking for industrial bulk or specified-grade supplies of Xenon trifluoride (CAS 13709-45-0)? Browse Supplier on Guidechem →

FAQs

Is F3Xe polar or nonpolar?

Xenon trifluoride is polar. Its see text geometry (and/or unequal terminal atoms) stops the bond dipoles from cancelling.

What is the Lewis structure of Xenon trifluoride?

Xe–F single bond, Xe–F single bond and Xe–F single bond; 2 lone pairs on Xe and one unpaired electron on Xe. It uses all 29 valence electrons and the preferred structure carries a formal charge of 1 on the central atom.

What is the bond angle in Xenon trifluoride?

The Xe angle is about —. Lone-pair repulsion compresses the angle from the ideal octahedral value.

What is the hybridization of Xe in Xenon trifluoride?

The conventional model is sp3d2. Xenon trifluoride has 6 electron domains around the central Xe.

What is the CAS number of Xenon trifluoride?

The CAS number is 13709-45-0. PubChem and NIST identify this with F3Xe; use it to locate suppliers and database records.

References

  1. PubChem, Xenon trifluoride. Molecular formula, CAS number, molecular weight and chemical identity.
  2. NIST Chemistry WebBook, SRD 69, Xenon trifluoride. Formula, CAS Registry Number and thermochemical / spectroscopic data.
  3. IUPAC Gold Book. Definitions for "lone pair", "VSEPR", "hybridization" and "formal charge".
  4. Atkins, P. & de Paula, J., Physical Chemistry. VSEPR, molecular geometry and dipole moments.
  5. Guidechem supplier & dictionary records. Commercial sourcing and CAS-linked property pages for Xenon trifluoride (CAS 13709-45-0).

Technical scope: Lewis structures, VSEPR and hybridization are model-based descriptions for chemical communication and structure prediction; actual molecular electronic structure is more accurately represented by molecular-orbital and quantum-chemical methods. Commercial grades vary substantially by supplier and intended use; CAS 13709-45-0 identifies the substance, not a universal purity specification.

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