VSEPR Molecular Shapes (3D)

Valence Shell Electron Pair Repulsion (VSEPR) predicts three-dimensional arrangements of electron domains (bonding pairs and lone pairs) around a central atom. The **steric number** is the count of those domains; it sets the **electron geometry** (linear, trigonal planar, tetrahedral, trigonal bipyramidal, or octahedral for two through six domains). **Molecular shape** describes where the bonded atoms actually sit once lone pairs—often modeled as slightly larger, more repulsive regions—occupy some of those directions. This lab shows an idealized **ball-and-stick plus translucent lone-pair lobes** sketch: domain vectors are fixed to symmetric polyhedra, and lone pairs follow simplified textbook placement rules (for example, lone pairs prefer equatorial sites on a trigonal bipyramid to reduce 90° crowding; two lone pairs on an octahedron are shown trans to each other so the four bonds lie in a plane). Sliders change the AXₙEₘ counts; presets recall common textbook examples such as CO₂, H₂O, NH₃, CH₄, PCl₅, SF₆, XeF₂, and XeF₄. The model is **pedagogical**, not a quantum geometry optimization: real bond angles differ when electronegativity and π bonding matter, and some hypervalent molecules need molecular-orbital ideas beyond first-year VSEPR cartoons.

Who it's for: High school and first-year college general chemistry students learning VSEPR tables, AXE notation, and the distinction between electron geometry and molecular shape before Walsh diagrams or computational structure.

Key terms

  • VSEPR theory
  • Steric number
  • Electron geometry
  • Molecular shape
  • AXE notation
  • Lone pair repulsion
  • Trigonal bipyramid
  • Octahedral geometry
  • Square planar
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How it works

Valence Shell Electron Pair Repulsion (VSEPR) predicts **electron geometry** from the steric number (bonding + lone pairs) and **molecular shape** from where atoms actually sit. Rotate the 3D model to compare textbook angles with this idealized ball-and-lone-pair sketch (not a quantum geometry optimization).

Key equations

Steric number = (# bonding domains) + (# lone pairs) on central atom
Lone pair – lone pair > lone pair – bond > bond – bond repulsion (qualitative)
Trigonal bipyramid: lone pairs prefer equatorial sites (less crowding).

Frequently asked questions

Why do lone pairs look like purple clouds instead of atoms?
They are a visualization of non-bonding valence electron density occupying direction around the central atom. The simulator does not draw orbitals; it marks directions where lone pairs are assumed to repel bonded pairs more strongly than bond–bond repulsion alone would suggest.
Are the bond angles exact numbers like 109.5°?
Only for perfect tetrahedral, octahedral, or trigonal bipyramidal reference geometry. The scene uses symmetric unit vectors; real molecules (H₂O, NH₃, etc.) deviate because lone pairs are not identical to bonds and electronegativity pulls electron density. Compare this page to quantitative experiments or quantum calculations when precision matters.
Why does XeF₂ use two bonds and three lone pairs on xenon?
It is a hypervalent example where the steric number is five (trigonal bipyramidal electron geometry) but three equatorial sites are lone pairs so the two fluorines sit on opposite axial positions—giving a **linear molecular shape** for the nuclei.
Does this replace a full molecular viewer?
No. The Molecule Viewer lab shows real coordinates for specific compounds. Here the goal is to connect **counts** of bonding and lone pairs to **named geometries** and to practice AXₙEₘ reasoning independent of a particular bond length.