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How to find the hybridization of an atom?

Published in Chemical Bonding 4 mins read

You can determine the hybridization of an atom in a molecule by analyzing the types of bonds surrounding it or by calculating its steric number. Both methods are effective and often used interchangeably or to cross-check results, particularly in organic chemistry.

Hybridization describes the mixing of atomic orbitals to form new hybrid orbitals suitable for the pairing of electrons to form chemical bonds. Understanding an atom's hybridization helps predict its molecular geometry and bond angles.

Method 1: Using the Steric Number

The steric number is a powerful and reliable way to determine an atom's hybridization. It represents the total number of electron domains around a central atom.

Steps to Calculate Steric Number:

  1. Draw the Lewis Structure: Begin by drawing an accurate Lewis structure for the molecule. This helps visualize all bonds and lone pairs around the central atom.
  2. Count Sigma (σ) Bonds: Count every single bond, and for multiple bonds (double or triple), count only *one* sigma bond. A double bond consists of one sigma and one pi (π) bond, and a triple bond consists of one sigma and two pi (π) bonds. Only sigma bonds contribute to the steric number.
  3. Count Lone Pairs: Count all non-bonding electron pairs (lone pairs) on the central atom.
  4. Sum for Steric Number: Add the number of sigma bonds and the number of lone pairs. This sum is the steric number.
  5. Determine Hybridization: Use the steric number to find the corresponding hybridization from the table below.

Steric Number and Hybridization Table:

The steric number directly correlates with the type of hybrid orbitals formed:
Steric Number Hybridization Ideal Electron Geometry Example
2 sp Linear CO2 (Carbon atom)
3 sp2 Trigonal Planar BF3 (Boron atom)
4 sp3 Tetrahedral CH4 (Carbon atom)
5 sp3d Trigonal Bipyramidal PCl5 (Phosphorus atom)
6 sp3d2 Octahedral SF6 (Sulfur atom)

Example: Finding the Hybridization of Carbon in Methane (CH4)

  • Lewis Structure: Carbon is bonded to four hydrogen atoms. There are no lone pairs on carbon.
  • Sigma Bonds: 4 (four C-H single bonds).
  • Lone Pairs: 0.
  • Steric Number: 4 + 0 = 4.
  • Hybridization: With a steric number of 4, the carbon atom in CH4 is sp3 hybridized.

Method 2: Analyzing Types of Bonds

This method is particularly intuitive for carbon atoms in organic molecules, though it applies to other atoms as well. It relies on the simple observation of how many "groups" (atoms or lone pairs) are attached to the central atom, which implicitly relates to the steric number.
  • sp3 Hybridization: Occurs when an atom is surrounded by four single bonds and no lone pairs (or a combination of single bonds and lone pairs that totals four electron domains).
    • Example: In ethane (CH3CH3), each carbon atom forms four single bonds (three to hydrogen, one to the other carbon). Both carbons are sp3 hybridized.
  • sp2 Hybridization: Occurs when an atom is involved in one double bond and two single bonds (or a combination of single/double bonds and lone pairs that totals three electron domains).
    • Example: In ethene (C2H4), each carbon atom forms one double bond to the other carbon and two single bonds to hydrogen atoms. Both carbons are sp2 hybridized.
  • sp Hybridization: Occurs when an atom is involved in one triple bond and one single bond, or two double bonds (or a combination of single/multiple bonds and lone pairs that totals two electron domains).
    • Example: In ethyne (C2H2), each carbon atom forms one triple bond to the other carbon and one single bond to a hydrogen atom. Both carbons are sp hybridized.

Practical Insights

When determining hybridization, always focus on the central atom in question. Both the steric number method and the bond-type analysis will yield the same result because the number of electron domains dictates the hybridization. For complex molecules, it's often easiest to draw the Lewis structure first and then apply the steric number calculation.