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Molecular mechanical and quantum chemical study on the species involved in the hydrolysis of cis-diamminedichloroplatinum(II) and substituted bis(ethylenediamine)dichloroplatinum(II) complexes. Part I. Reactants and products

Nikolov, G. St and Trendafilova, N. and Schönenberger, Helmut and Gust, Ronald and Kritzenberger, J. and Yersin, Hartmut (1994) Molecular mechanical and quantum chemical study on the species involved in the hydrolysis of cis-diamminedichloroplatinum(II) and substituted bis(ethylenediamine)dichloroplatinum(II) complexes. Part I. Reactants and products. Inorganica chimica acta 217 (1-2), pp. 159-170.

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Abstract

Cisplatin and its substituted ethylenediamine derivs., cis-PtCl2(R2en) (en = ethylenediamine, R = H, Ph, 2-, 3- and 4-PhOH) have been studied with respect to the first step of their hydrolysis reaction. The geometry of the reactants and products was detd. by mol. mechanics (MM). The MM optimized structures were used to calc. by the extended Hueckel method the charge distribution and relative ...

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Item Type:Article
Date:1994
Additional information (public):CAN 121:19167 67-3 Catalysis, Reaction Kinetics, and Inorganic Reaction Mechanisms 51772-49-7; 53861-42-0; 143988-09-4; 155830-96-9 Role: RCT (Reactant), RACT (Reactant or reagent) (energy and at. charge distribution of, as hydrolysis product, mol. mech. and quantum chem. study of); 155899-95-9; 155899-96-0 Role: RCT (Reactant), RACT (Reactant or reagent) (energy and at. charge distribution of, as hydrolysis product, mol. mech. and quantum chem. study of racemic); 142760-37-0; 142760-38-1 Role: PRP (Properties) (hydrolysis kinetics of); 14096-51-6; 15663-27-1 (Cisplatin); 81520-29-8; 90130-44-2; 91265-66-6; 91326-61-3; 93856-31-6; 93983-45-0; 138230-33-8; 138258-84-1 Role: RCT (Reactant), RACT (Reactant or reagent) (hydrolysis of, mol. mech. and quantum chem. study of)
Institutions:Chemistry and Pharmacy > Institute of Pharmacy > Retired Professors > Prof. Schönenberger
Projects:SFB 234
Identification Number:
ValueType
1994:419167Other
Keywords:Hydrolysis Kinetics of hydrolysis (of cis-diamminedichloroplatinum(II) and substituted bis(ethylenediamine)dichloroplatinum(II) complexes, mol. mech. and quantum chem. study of) Molecular mechanics Quantum chemistry (of hydrolysis of cis-diamminedichloroplatinum(II) and substituted bis(ethylenediamine)dichloroplatinum(II) complexes) Energy level (electronic, in cis-diamminedichloroplatinum(II) and substituted bis(ethylenediamine)dichloroplatinum(II) complexes undergoing hydrolysis, mol. mech. and quantum chem. study of) cisplatin hydrolysis mol mechanic quantum chem ammine chloro platinum hydrolysis kinetics ethylenediamine chloro platinum hydrolysis kinetics
Subjects:500 Science > 540 Chemistry & allied sciences
Status:Published
Refereed:Yes, this version has been refereed
Created at the University of Regensburg:Yes
Owner: Petra Gürster
Deposited On:10 Nov 2010 12:03
Last Modified:12 Nov 2010 06:22
Item ID:17705
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