Hub
NodeNode / Manipulator

Orbital Electronegativity

ChemAxon / Infocom JChem Calculator Plugins Charge Streamable
Drag & drop
Like
Copy short link

Partial charge distribution of the molecule is governed by the orbital electronegativity (orbital EN) of the atoms in the molecule. The Orbital Electronegativity Plugin is able to calculate the orbital EN values of atoms in a molecule.

Node details

Input ports
  1. Type: Table
    Data Input
    Input table that contains structure in Structure(Mrv, Sdf, Smiles, etc.) format.
Output ports
  1. Type: Table
    Data Output
    Output table that contains orbital electronegativity.

Extension

The Orbital Electronegativity node is part of this extension: