19 и 21 мая проф. Лимбах провел первую часть семинара G-RISC “NMR as interdisciplinary tool for the study of non-covalent interactions”.
Были сделаны следующие доклады:
- Hans Limbach Introductory lecture
- Andrey Gurinov “NMR Study of Lewis and Brønsted acidic centers of aluminated SBA-15 silicas”
- Ruslan Asfin “Advantages of IR spectroscopy in study of weak complexes in the gas phase”
- Peter Tolstoy “Low-temperature NMR and combined UV-NMR spectroscopy”
- Elena Tupikina “Hydrogen bonds formed by CH-acids: structure and NMR properties of 1,1-dinitroethane complexes with proton acceptors”
- Mariya Sandzhieva «Cyclic trifluorometilated bromonium cation: formation, reactions and NMR study»
- Svetlana Pylaeva “The influence of solvent fluctuations on proton transfer in complexes with strong hydrogen bonds studied by molecular dynamics”
Из РЦ МРМИ уволилась Светлана Пылаева. Мы желаем Светлане всего самого наилучшего на новом месте работы!
E.Yu. Bulatov, T.G. Chulkova, I.A. Boyarskaya, V.V. Kondratiev, M. Haukka, V.Yu. Kukushkin
“Triple associates based on (oxime)Pt(II) species, 18-crown-6, and water: Synthesis, structural characterization, and DFT study”
J. Molec. Struct. 2014, 1068, 176-181
DOI: 10.1016/j.molstruc.2014.04.010
The associates 2(cis-[PtCl2(acetoxime)2])⋅18-crown-6⋅2H2O (1), 2(cis-[PtBr2(acetoxime)2])⋅18-crown-6⋅2H2O (2), and trans-[PtCl2(acetaldoxime)2]⋅(18-crown-6)⋅2H2O (3) were synthesized by co-crystallization of free corresponding platinum species and 18-crown-6 from wet solvents and characterized by 1H NMR and IR spectroscopies, high-resolution mass-spectrometry (ESI), TG/DTA, and X-ray crystallography. The (oxime)Pt(II) species are assembled with 18-crown-6 and water by hydrogen bonding between the hydroxylic hydrogen atoms of the oxime ligands and the oxygen atom of water and between the hydrogen atoms of water and the oxygen atoms of 18-crown-6. In 2(cis-[PtX2(acetoxime)2])⋅18-crown-6⋅2H2O (where X = Cl (1), Br (2)), the molecule of the crown ether is located between the two cis-[PtX2(acetoxime)2] species. The associate trans-[PtCl2(acetaldoxime)2]⋅(18-crown-6)⋅2H2O (3) crystallizes into a 1D array structure. Water molecules play the role of linkers between the (oxime)Pt(II) species and the crown ether molecules. The electronic structures and vibrational frequencies of the triple associates were studied by density functional theory (DFT/B3LYP).
На экскурсию познакомиться с методом ЯМР приходили студенты магистры 1 года обучения с химического факультета СПбГУ.
20-22 Октября 2014
1-я междисциплинарная конференция
«Современные решения для исследования природных, синтетических и биологических материалов»
