Synthesis, characterization, X-ray structural determination and theoretical study of the complexes [RuCp(8MTT-κS)LL′] (8MTT = 8-methylthio-theophyllinate; L,L′ = PTA, mPTA; L = mPTA, L′ = PPh₃; PTA = 1,3,5-triaza-7-phosphaadamantane, mPTA =

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• 作者：Lazhar Hajji ; Vicente Jara-Pé ; rez ; Cristobal Saraiba-Bello ; Gaspar Segovia-Torrente ; Manuel Serrano-Ruiz ; Antonio Romerosa
• 关键词：Ruthenium ; Water soluble complexes ; PTA derivatives ; Thio-purines ; Theoretical studies ; DFT
• 刊名：Inorganica Chimica Acta
• 出版年：2017
• 出版时间：30 January 2017
• 年：2017
• 卷：455
• 期：part_P2
• 页码：557-567
• 全文大小：2045 K
• 卷排序：455

文摘

Synthesis of tow new examples of Ru-metal-κS-coordination-thioethers. Water soluble ruthenium complexes with PTA and thiopurines. Theoretical evaluation of κS- and κN-thioether coordination. Stability of κS-thioether coordination larger than κN-thioether coordination in protic solvents. The IR is not useful for determining κS- and κN-thioether coordination in {CpRu(L)(L′)} units.