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What are the 5 main shapes of molecules?

Published in Molecular Geometry 4 mins read

The five main shapes of simple molecules, determined by the arrangement of electron groups around a central atom according to the VSEPR (Valence Shell Electron Pair Repulsion) theory, are linear, trigonal planar, tetrahedral, trigonal bipyramidal, and octahedral. Understanding these fundamental geometries is crucial in chemistry, as molecular shape significantly influences a molecule's properties, including its polarity, reactivity, and biological function.

Understanding Molecular Geometry

Molecular geometry describes the three-dimensional arrangement of atoms in a molecule. This arrangement is primarily dictated by the number of electron domains (bonding pairs and lone pairs) around the central atom, which repel each other and thus spread out as much as possible to minimize repulsion. This concept is encapsulated by the VSEPR theory.

Here are the five primary molecular shapes:

1. Linear

  • Description: In a linear molecule, the central atom is bonded to two other atoms, with all three atoms lying in a straight line. The electron domains are arranged 180° apart.
  • Electron Domains: 2
  • Ideal Bond Angle: 180°
  • Examples:
    • Carbon dioxide (CO₂)
    • Beryllium chloride (BeCl₂)
    • Hydrogen cyanide (HCN) – the H-C-N atoms form a line.
  • Practical Insight: Linear molecules often have no net dipole moment if the bonds are identical and symmetrically arranged, like CO₂, making them nonpolar.

2. Trigonal Planar

  • Description: A trigonal planar molecule has a central atom bonded to three other atoms, with all four atoms lying in the same plane. The surrounding atoms are positioned at the corners of an equilateral triangle.
  • Electron Domains: 3
  • Ideal Bond Angle: 120°
  • Examples:
    • Boron trifluoride (BF₃)
    • Sulfur trioxide (SO₃)
    • Carbonate ion (CO₃²⁻)
  • Practical Insight: Like linear molecules, symmetrical trigonal planar molecules such as BF₃ are nonpolar, as the bond dipoles cancel each other out due to their symmetrical arrangement.

3. Tetrahedral

  • Description: In a tetrahedral molecule, the central atom is bonded to four other atoms, which are positioned at the vertices of a tetrahedron. The central atom is at the center of this 3D shape.
  • Electron Domains: 4
  • Ideal Bond Angle: 109.5°
  • Examples:
    • Methane (CH₄)
    • Carbon tetrachloride (CCl₄)
    • Ammonium ion (NH₄⁺)
    • Silane (SiH₄)
  • Practical Insight: The tetrahedral shape is one of the most common geometries, fundamental to organic chemistry and the structure of many biological molecules. For instance, the carbon atom in organic compounds often exhibits this geometry.

4. Trigonal Bipyramidal

  • Description: This shape features a central atom bonded to five other atoms. These five atoms occupy two distinct positions: three are in an equatorial plane (forming a trigonal planar arrangement), and two are axial (above and below the plane).
  • Electron Domains: 5
  • Ideal Bond Angles: 90° (axial to equatorial) and 120° (equatorial to equatorial)
  • Examples:
    • Phosphorus pentachloride (PCl₅)
    • Arsenic pentafluoride (AsF₅)
  • Practical Insight: Molecules with this geometry can sometimes exhibit fluxional behavior, where the axial and equatorial atoms exchange positions, a process known as Berry pseudorotation.

5. Octahedral

  • Description: An octahedral molecule has a central atom bonded to six other atoms, which are positioned at the vertices of an octahedron. This results in a highly symmetrical 3D structure where all bond angles are 90 degrees.
  • Electron Domains: 6
  • Ideal Bond Angle: 90°
  • Examples:
    • Sulfur hexafluoride (SF₆)
    • Tellurium hexafluoride (TeF₆)
    • Hexaamminecobalt(III) ion ([Co(NH₃)₆]³⁺)
  • Practical Insight: Octahedral complexes are very common in coordination chemistry, influencing the color, magnetic properties, and reactivity of transition metal compounds.

Summary of Main Molecular Shapes

To summarize, the five main molecular shapes, as described by VSEPR theory, are crucial for predicting and understanding the properties of chemical compounds:

Molecular Shape Number of Electron Domains Ideal Bond Angle(s) Example Molecules
Linear 2 180° CO₂, BeCl₂, HCN
Trigonal Planar 3 120° BF₃, SO₃, CO₃²⁻
Tetrahedral 4 109.5° CH₄, CCl₄, NH₄⁺
Trigonal Bipyramidal 5 90°, 120° PCl₅, AsF₅
Octahedral 6 90° SF₆, TeF₆, [Co(NH₃)₆]³⁺

Understanding these basic geometries provides a strong foundation for exploring more complex molecular structures and their impact on chemical and physical behaviors.