Molecular Information File dictionary (MIF) version 1.2.3

_atom_radical_count

Name:
'_atom_radical_count'

Definition:

   Specifies the formal radical state of the atom site identified
   by _atom_id. This is the number of unpaired electrons associated
   with the atom, e.g. the value of 1 specifies one singly
   occupied orbital on the atom that is not involved in bonding.

Appears in list containing _atom_id


The permitted range is 0 -> infinity

Type: numb

Category: atom









































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