CCL: Charge deomposition

The charge for cationic and anionic fragments is +1 and -1, respectively. The spin multiplicity for both ion is 2 (doublet)

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On Mon, 20 Jul 2020 at 12:15 PM, Partha Sengupta anapspsmo:_:gmail.com
<owner-chemistry:+:ccl.net> wrote:
Sir, I have to calculate charge decomposition of C6H5Cl using Multiwfn. For the total molecule charge is 0 with multiplicity 1. Now what will be the charge and multiplicity for "C6H5" fragment and "Cl" fragment. 
Waiting for response.
Partha.


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Dr. Partha Sarathi Sengupta
Associate Professor
Vivekananda Mahavidyalaya, Burdwan