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VSEPR Theory & Hybridization

Chemical Bonding and Molecular Structure · free study notes · Updated

VSEPR Theory & Hybridization

Chemistry – COMEDK


1. Simple Explanation

Concept What it is Why it matters
VSEPR (Valence‑Shell Electron‑Pair Repulsion) A theory that predicts the 3‑D arrangement of atoms around a central atom by treating bonding pairs and lone pairs of electrons as “repelling” each other. Gives the molecular shape (e.g., bent, trigonal planar) and predicts bond angles.
Hybridization The mixing of atomic orbitals (s, p, d) on the central atom to form new, equivalent hybrid orbitals that host the valence electron pairs. Explains how bond angles and molecular shapes can be derived from the types of hybrid orbitals (sp, sp², sp³, sp³d, sp³d²).

In a nutshell, VSEPR tells where the electron pairs will sit; hybridization tells how the central atom’s orbitals adjust to accommodate those pairs.


2. Key Points

2.1 VSEPR Basics

Step What to do Example
Count electron domains Count bonding pairs + lone pairs around the central atom. In H₂O: 2 bonds + 2 lone pairs = 4 domains.
Determine electron‑domain geometry 1, 2, 3, 4, 5, or 6 domains → Linear, Trigonal planar, Tetrahedral, Trigonal bipyramidal, or Octahedral. 4 domains → Tetrahedral.
Determine molecular geometry Remove lone pairs from the picture. 4 domains, 2 lone pairs → Bent shape.
Predict bond angles Use ideal angles for the geometry, adjust for lone‑pair repulsion (lone pairs push bonds closer). Bent H₂O → ~104.5° (vs. 109.5° tetrahedral).

Rule of thumb: Lone pairs exert more repulsion than bonding pairs.

2.2 Hybridization Rules

Hybridization Orbits involved Number of hybrid orbitals Typical geometries
sp 1 s + 1 p 2 Linear (180°)
sp² 1 s + 2 p 3 Trigonal planar (120°)
sp³ 1 s + 3 p 4 Tetrahedral (109.5°)
sp³d 1 s + 3 p + 1 d 5 Trigonal bipyramidal (90°/120°)
sp³d² 1 s + 3 p + 2 d 6 Octahedral (90°)

Caveat: Hybridization is a useful mnemonic; for very small molecules (e.g., H₂) it’s not strictly necessary, and for hypervalent molecules (PF₅, SF₆) the “d‑orbitals” may not be heavily involved (just a convenient way to rationalise geometry).

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