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Chemistry

VSEPR molecular shapes

General chemistry · Molecular geometry

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Why is a water molecule bent like a boomerang, while carbon dioxide is perfectly straight?

Around the central atom of a molecule, groups of electrons push each other as far apart as they can. Counting those groups tells you the shape. Some groups are bonds to other atoms; others are “lone pairs” that you cannot see but that still push.

Valence-shell electron-pair repulsion (VSEPR) theory predicts molecular shape by assuming that the electron domains around a central atom — bonds and lone pairs — arrange themselves to be as far apart as possible. The number of domains fixes the electron geometry, and the positions of the atoms alone give the molecular shape, with lone pairs compressing the angles between bonds.

Key facts

Electron domains
2 → 180°, 3 → 120°, 4 → 109.47°, 5 → 90°/120°, 6 → 90°
Tetrahedral angle
arccos(−1/3) = 109.47°
Repulsion order
lone pair–lone pair > lone pair–bond pair > bond pair–bond pair
Bond angles, CH₄ → NH₃ → H₂O
109.5° → 106.7° → 104.5°
Lone pairs in a trigonal bipyramid
Always equatorial
Lone pairs in an octahedron
Trans (opposite each other)

Parts you can explore (13)

In the 3D model

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