Chemistry

VSEPR theory and molecular shapes

VSEPR theory predicts a molecule's shape from the electron groups around its central atom. Electron groups (bonds and lone pairs) repel each other, so they spread out as far apart as possible. Count the groups to get the electron geometry, then look only at where the atoms are to name the molecular shape. A double or triple bond counts as one group, and lone pairs push a little harder than bonds.

Updated

Key ideas

  • Electron group. Any single bond, double bond, triple bond or lone pair on the central atom counts as 1 group.
  • Electron geometry is the arrangement of all the groups, lone pairs included.
  • Molecular shape describes only where the atoms are. Lone pairs are there, but you do not see them in the shape name.
  • Lone pairs squeeze bond angles. They take up more room than bonding pairs, so NH3\mathrm{NH_3} is 107° and H2O\mathrm{H_2O} is 104.5°, not 109.5°.

Use the shorthand AXmEn\mathrm{AX_mE_n}: A is the central atom, X stands for each bonded atom and E for each lone pair on A.

VSEPR shapes chart
GroupsBonded atomsLone pairsMolecular shapeBond angleExample
220Linear180°CO2\mathrm{CO_2}, BeCl2\mathrm{BeCl_2}
330Trigonal planar120°BF3\mathrm{BF_3}
321Bentless than 120°SO2\mathrm{SO_2}
440Tetrahedral109.5°CH4\mathrm{CH_4}
431Trigonal pyramidalabout 107°NH3\mathrm{NH_3}
422Bentabout 104.5°H2O\mathrm{H_2O}
550Trigonal bipyramidal90° and 120°PCl5\mathrm{PCl_5}
541Seesawless than 90° and 120°SF4\mathrm{SF_4}
532T-shapedless than 90°ClF3\mathrm{ClF_3}
523Linear180°XeF2\mathrm{XeF_2}
660Octahedral90°SF6\mathrm{SF_6}
651Square pyramidalless than 90°BrF5\mathrm{BrF_5}
642Square planar90°XeF4\mathrm{XeF_4}

Shape decides polarity

A molecule is polar if its bond dipoles do not cancel. If the central atom has no lone pairs and all the outer atoms are the same, the shape is symmetric and the molecule is nonpolar, even with polar bonds (CO2\mathrm{CO_2}, CH4\mathrm{CH_4}, BF3\mathrm{BF_3}). Lone pairs on the central atom (H2O\mathrm{H_2O}, NH3\mathrm{NH_3}) or different outer atoms (CH3Cl\mathrm{CH_3Cl}) usually make it polar. Two exceptions in the chart: XeF2\mathrm{XeF_2} and XeF4\mathrm{XeF_4} have lone pairs but are symmetric, so they are nonpolar.

Worked examples

Example 1: ammonia

Problem Predict the shape and bond angle of NH3\mathrm{NH_3}.

  1. Lewis structure: 8 valence electrons. N has 3 single bonds to H (6 electrons) and 1 lone pair (2 electrons).
  2. Groups on N: 3 bonds + 1 lone pair = 4. Electron geometry: tetrahedral.
  3. Only 3 of the 4 groups are atoms, so the shape is a pyramid with N on top. The lone pair pushes the H atoms closer, from 109.5° to about 107°.

Answer Trigonal pyramidal, about 107°

Example 2: carbon dioxide

Problem Predict the shape of CO2\mathrm{CO_2} and say if it is polar.

  1. Lewis structure: O=C=O, no lone pairs on C.
  2. Each double bond is 1 group, so C has 2 groups. Two groups point opposite ways: 180°.
  3. Each C=O bond is polar, but the two point in opposite directions and cancel.

Answer Linear, 180°, nonpolar

Example 3: an expanded octet

Problem Predict the shape of sulfur tetrafluoride, SF4\mathrm{SF_4}.

  1. Count: 6+4×7=346 + 4 \times 7 = 34 valence electrons.
  2. Four S-F bonds use 8. Each F takes 3 lone pairs: 4×6=244 \times 6 = 24. That leaves 34−8−24=234 - 8 - 24 = 2 electrons, 1 lone pair on S.
  3. Groups on S: 4 bonds + 1 lone pair = 5, so the electron geometry is trigonal bipyramidal. With 1 lone pair the shape is a seesaw.

Answer Seesaw (AX4E\mathrm{AX_4E})

Common mistakes and how to fix them

  • Skipping the Lewis structure. You cannot count lone pairs without it. Fix: draw it first, see how to draw Lewis structures.
  • Counting a double bond as 2 groups. Fix: any bond between two atoms is 1 group, single, double or triple.
  • Naming the electron geometry instead of the shape. Water's electron geometry is tetrahedral, but its shape is bent. Fix: name the shape from the atoms only.
  • Counting lone pairs on outer atoms. Fix: only lone pairs on the central atom change the shape.
  • Calling every molecule with polar bonds polar. Fix: check whether the shape is symmetric.

Practice questions

  1. What is the shape of methane, CH4\mathrm{CH_4}?

    1. Square planar
    2. Tetrahedral
    3. Trigonal pyramidal
    4. Bent
    Show answer

    Answer: Tetrahedral

    C has 4 bonds and no lone pairs, so 4 groups and 4 atoms: tetrahedral, 109.5°.

  2. What is the shape of water, H2O\mathrm{H_2O}?

    1. Linear
    2. Bent
    3. Trigonal planar
    4. Tetrahedral
    Show answer

    Answer: Bent

    O has 2 bonds and 2 lone pairs, so 4 groups but only 2 atoms. The shape is bent, about 104.5°.

  3. What is the bond angle in boron trifluoride, BF3\mathrm{BF_3}?

    1. 90°
    2. 109.5°
    3. 120°
    4. 180°
    Show answer

    Answer: 120°

    Boron has 3 bonds and no lone pairs (24 electrons: 3 bonds use 6, the F atoms take 18). Three groups spread to 120° in a flat triangle.

  4. What is the shape of phosphorus trichloride, PCl3\mathrm{PCl_3}?

    1. Trigonal planar
    2. Trigonal pyramidal
    3. T-shaped
    4. Tetrahedral
    Show answer

    Answer: Trigonal pyramidal

    26 valence electrons. 3 bonds use 6, the Cl atoms take 18, and 2 are left as 1 lone pair on P. 3 bonds + 1 lone pair: trigonal pyramidal, like ammonia.

  5. Which molecule is nonpolar?

    1. H2O\mathrm{H_2O}
    2. NH3\mathrm{NH_3}
    3. SO2\mathrm{SO_2}
    4. CO2\mathrm{CO_2}
    Show answer

    Answer: CO2\mathrm{CO_2}

    CO2\mathrm{CO_2} is linear with identical outer atoms, so its bond dipoles cancel. The other three have a lone pair or two on the central atom, which makes them bent or pyramidal and polar.

Frequently asked questions

What does VSEPR stand for?

Valence Shell Electron Pair Repulsion. The name is the whole idea: electron pairs in the outer (valence) shell of the central atom repel each other, so they arrange themselves as far apart as possible, and that arrangement sets the shape.

Why are lone pairs stronger repellers than bonds?

A lone pair is held by only one nucleus, so it spreads out wider and sits closer to the central atom. A bonding pair is pulled between two nuclei. The wider lone pair pushes the bonds closer together, which is why angles shrink.

Do I need to know the shapes with 5 and 6 groups?

For most first-year courses, the 2, 3 and 4 group shapes are enough. AP Chemistry and many honors courses also use 5 and 6 groups (seesaw, T-shaped, square planar), which show up with central atoms like S, P, Cl and Xe.

Sources

  1. OpenStax Chemistry 2e, 7.6 Molecular Structure and Polarity, accessed October 1, 2026

Try asking Ducky

  • “I said water is tetrahedral and got it wrong. Show me the difference between electron geometry and shape on my drawing.”
  • “Check my AXE labels for the molecules on my worksheet.”
  • “Is CH2Cl2 polar? Walk me through it without giving the answer away.”

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