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Xenon trioxide Lewis Structure

Xenon trioxide Lewis structure (H2O3Xe). Xe–O single bond, Xe–O double bond and Xe–O single bond. It shows a t-shaped shape, sp3d hybridization on Xe, ≈87.5° bond angles. Includes a comparison table and FAQs. Zapata3 MIN READSeptember 30, 2026

Xenon trioxide Lewis Structure: H2O3Xe Lewis Structure, T-shaped Geometry, sp3d Hybridization & Polarity

Xenon trioxide Lewis structure Cover

Xenon trioxide Key Facts

The Xenon trioxide Lewis structure is Xe–O single bond, Xe–O double bond and Xe–O single bond; the central Xe has 5 electron domains (2 lone pairs), giving a trigonal bipyramidal electron-domain arrangement and a T-shaped molecular geometry with a ≈87.5° bond angle. Xe is best described as sp3d-hybridized, and Xenon trioxide is polar because the T-shaped shape (and/or unequal terminal atoms) prevents cancellation of the bond dipoles.

Xenon trioxide Lewis Structure Figure 1: Lewis Structure of Xenon trioxide (H2O3Xe)
Chemical Formula H2O3Xe
CAS Number 13776-58-4
Total Valence Electrons 28
Lewis Structure Xe–O single bond, Xe–O double bond and Xe–O single bond
Electron-Domain Geometry trigonal bipyramidal
Molecular Geometry T-shaped
Hybridization Model sp3d (central Xe)
Bond Angle ≈87.5°
Polarity Polar molecule
PubChem (CID 177839438) and NIST list Xenon trioxide as H 2O 3Xe with CAS 13776-58-4; molecular weight ≈ 181.31 g/mol. View CAS 13776-58-4 dictionary details on Guidechem →

Applications of Xenon trioxide (CAS 13776-58-4)

Noble-gas compounds such as Xenon trioxide 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 trioxide" 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 13776-58-4 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 trioxide Lewis structure we first count the total valence electrons. H2O3Xe contains 2×1 (H) + 3×6 (O) + 8 (Xe); the net charge of 0 gives a total of 28 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 = 2×1 (H) + 3×6 (O) + 8 (Xe) = 28 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–O single bond, Xe–O double bond and Xe–O single bond; 2 lone pairs on Xe.

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

This species is best represented by resonance structures; the π bonding is delocalized over the equivalent terminal atom(s), so all Xe–terminals bonds are equivalent in the resonance hybrid.

Xe–O Xe=O Xe–O
Xe: 2 lone pairs, 3 bonding domains
3 bonding domains + 2 lone pairs = 5 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 T-shaped arrangement with 5 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 5 electron domains around Xe arrange to minimize mutual repulsion, giving an trigonal bipyramidal 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 T-shaped; the Xe bond angle is set to ≈87.5° 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 sp3d hybrid orbitals to form the 5 equivalent electron-domain directions (3 bonding + 2 lone pair).

Formal-charge check

Formal charge on central Xe = V − N − ½B = 8 − 4 − ½×8 = 0. The preferred Lewis structure carries zero formal charge on the central atom (and on the terminals), so it is the dominant contributor.

Modeling Note Modeling Note: sp3d / sp3d hybridization is a convenient localized-bond teaching model. Modern quantum-chemical descriptions of hypervalent Xenon trioxide use molecular orbitals and do not require populated d orbitals as the primary bonding picture.

Is Xenon trioxide Polar or Nonpolar?

Xenon trioxide is polar. The T-shaped 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 trioxide the T-shaped 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 trioxide H2O3Xe Xe 5 T-shaped 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 28 valence electrons of H2O3Xe, draw the Lewis structure and confirm the central Xe atom is sp3d-hybridized with T-shaped 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 trioxide (CAS 13776-58-4)? Browse Supplier on Guidechem →

FAQs

Is H2O3Xe polar or nonpolar?

Xenon trioxide is polar. Its T-shaped geometry (and/or unequal terminal atoms) stops the bond dipoles from cancelling.

What is the Lewis structure of Xenon trioxide?

Xe–O single bond, Xe–O double bond and Xe–O single bond; 2 lone pairs on Xe. It uses all 28 valence electrons and the preferred structure carries zero formal charge on the central atom.

What is the bond angle in Xenon trioxide?

The Xe angle is about ≈87.5°. Lone-pair repulsion compresses the angle from the ideal trigonal bipyramidal value.

What is the hybridization of Xe in Xenon trioxide?

The conventional model is sp3d. Xenon trioxide has 5 electron domains around the central Xe.

What is the CAS number of Xenon trioxide?

The CAS number is 13776-58-4. PubChem (CID 177839438) and NIST identify this with H2O3Xe; use it to locate suppliers and database records.

References

  1. PubChem CID 177839438, Xenon trioxide. Molecular formula, CAS number, molecular weight and chemical identity.
  2. NIST Chemistry WebBook, SRD 69, Xenon trioxide. 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 trioxide (CAS 13776-58-4).

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 13776-58-4 identifies the substance, not a universal purity specification.

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