From shj@sbc2.kist.re.kr  Sat May 11 03:52:14 1996
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Date: Sat, 11 May 1996 16:15:09 -0800
From: shj@sbc2.kist.re.kr (sun-hee jung)
Message-Id: <199605120015.QAA21070@sbc2.kist.re.kr>
To: chemistry@www.ccl.net
Subject: 5 coordinated Fe(II, or III) ion study



  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 !!!

From unipune.ernet.in!gadre@iucaa.ernet.in  Sat May 11 09:52:16 1996
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Date: Sat, 11 May 1996 12:28:10 +0500
From: gadre@unipune.ernet.in (Faculty)
Message-Id: <9605111728.AA05282@unipune.ernet.in>
To: CHEMISTRY@www.ccl.net
Subject: Weak complexes of cyclopropane and benzene.
Cc: gadre@unipune.ernet.in


Dear Sirs :
	We are currently working on the modelling of cyclopropane
and benzene complexes with HF, HCl, HCN, H2O, NH3, CH3OH, H2S.  
We are interested in knowing the interaction energies and the 
intermolecular geometrical parameters.
Are there any experimental or theoretical references for these systems?
We will appreciate receiving these references.
Thank You.
Shridhar Gadre (e-mail : gadre@parcom.ernet.in ; gadre@unipune.ernet.in)
May 11, 1996.