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Int. J. Mol. Sci. 2001, 2(3), 148-155; doi:10.3390/i2040148

Quantum Chemical Studies on Molecular and Electronic Structure of Platinum and Tin Adducts with Guanine

1
Institute of Physical and Theoretical Chemistry, I-30, Wroclaw University of Technology, Wyb. Wyspiañskiego 27, 50-370 Wroclaw, Poland
2
Faculty of Chemistry, Wroclaw University, ul. F. Joliot-Curie 14, 50-383 Wroclaw, Poland
*
Author to whom correspondence should be addressed.
Received: 3 August 2001 / Accepted: 18 October 2001 / Published: 25 October 2001
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Abstract

The electronic structure of model platinum-guanine and tin-guanine adducts has been studied both at semiempirical level and by using ab initio methods at the correlation level. The possible binding energies have been evaluated and most probable strustures were determined. In all cases the binding enegies of the gaseous tin chelates are rather large. The stabilizing role of the hydrogen bonds has been pointed out in tinguanine chelates as well as comparison with the relevant platinum complexes is discussed.
Keywords: molecular and electronic structure; platinum-guanine adducts; tin-guanine adducts; hydrogen bonding; quantum-chemical calculations molecular and electronic structure; platinum-guanine adducts; tin-guanine adducts; hydrogen bonding; quantum-chemical calculations
This is an open access article distributed under the Creative Commons Attribution License (CC BY 3.0).

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MDPI and ACS Style

Chojnacki, H.; Kolodziejczyk, W.; Pruchnik, F. Quantum Chemical Studies on Molecular and Electronic Structure of Platinum and Tin Adducts with Guanine. Int. J. Mol. Sci. 2001, 2, 148-155.

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Int. J. Mol. Sci. EISSN 1422-0067 Published by MDPI AG, Basel, Switzerland RSS E-Mail Table of Contents Alert
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