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Quantum chemistry calculations can predict the value of the partial charge on...

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Quantum chemistry calculations can predict the value of the partial charge on an atom when bonded to other atoms, i.e. the excess or deficiency of electrons compared to the number of protons around the atom. A quantum chemistry calculation for SCl2 (with the sulfur as the central atom) was performed, and the calculation gave partial charges of –0.402 for the sulfur atom and 0.201 for both chlorine atoms.

  • Based on these results, sulfur has
    electronegativity than chlorine. [1 mark]

  • If a similar calculation was done for water, the magnitude of the partial charge on oxygen would be 
    the partial charge of sulfur in SCl2. [1 mark]
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