Subject: 5 coordinated Fe(II, or III) ion study

From: [email-masked] (sun-hee jung)
Date: Sat, 11 May 1996 16:15:09 -0800

Hi, Dear Netters ! 

  I'd like to know whether there has been quantum mechanical study of 
  Fe ion (either 2+ or 3+ charged) with 5 coordination chemistry, 
  with like histidine, or aspartate amino acid type of ligand. 
  I'd like to know especially, partial charges, and geometry of 
  Fe ion in the 5 liganded state. 

  Any reference and/or quote of your past and current study will be 
  appreciated. 

  Thank you very much for your help !!!