Conference program

 

Joint Session Zoom-room

Joint Session

Zoom-room

Parallel Session 1 Zoom-room

Parallel Session 1

Zoom-room

Parallel Session 2 Zoom-room

Parallel Session 2

Zoom-room

Parallel Session 3 Zoom-room

Parallel Session 3

Zoom-room

Parallel Session 4 Zoom-room

Parallel Session 4

Zoom-room

 

Joint Session Zoom-room

Farewell

Zoom-room

4 September, Sunday

17:30-19:00 Registration, ICKC Hall

5 September, Monday

08:15-9:00 Registration, Dom Uchenykh, Congress hall, 2nd floor

 

  Session chair: Andrey Onischuk
09:00-09:10 Opening Ceremony: Renad Sagdeev
09:10-09:20 Welcome Address of SB RAS President Valentin Parmon
09:20-09:30 Voevodsky Award Ceremony
09:30-10:10 Voevodsky Award Lecture 1
10:10-10:50 Voevodsky Award Lecture 2
10:50-11:10 Sergey Dzuba, Double Electron-Electron Resonance of Molecular Clusters in Biological Membranes
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
11:10-11:30 Coffee break
  Session chair: Igor Koptyug
11:30-12:10 Zinfer Ismagilov, Catalytic processing of coalbed methane into useful chemical products to reduce the carbon footprint and anthropogenic impact on the climate
The Federal Research Center of Coal and Coal Chemistry SBRAS, Kemerovo
12:10-12:30 Nikita Lukzen, Review of magnetic and spin effects in charge separated states in the triads "electron donor - hard molecular bridge - electron acceptor"
International Tomography Center SBRAS, Novosibirsk
12:30-13:10 Guenter Grampp (Online), ESR-Spectroscopy in Ionic Liquids: High Presse Investigations on the Rotational Dynamics of Some Nitroxides
Graz University of Technology, Institute of Physical & Theoretical Chemistry, Austria
13:10-14:30 Lunch break

 

  Chemical Physics in Biology and Medicine
Chair: Sergey Valiulin
14:30-14:50 Tatyana Leshina, Using spin chemistry and photochemistry in the chiral model systems to study the role of D amino acids in the Alzheimer's disease
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
14:50-15:10 Sergei Babailov, Lanthanide complexes with lipids as nonlinear NMR sensors of the local temperature due to both paramagnetic lanthanide-induced shifts and relaxation rates
Nikolaev Institute of Inorganic Chemistry SBRAS, Novosibirsk
15:10-15:30 Olga Selyutina, The interaction of quinone-chelators with lipid membrane: 1H NMR and MD study
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
15:30-15:50 Vitaly Kol’tover (Online), Nuclear spin catalysis in biochemical reactions driven by biomolecular motors
Institute of Problems of Chemical Physics RAS, Chernogolovka
15:50-16:10 Coffee break
  Combustion and Energetic Materials
Chair: Denis Knyazkov
16:10-16:30 Vladimir Zarko, Erroneous use of balance equations in combustion theory of energetic materials
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
16:30-16:50 Oleg Glotov, Burning times of boron, aluminum diboride and aluminum dodecaboride microparticles
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
16:50-17:10 Natalia Belousova, Effect of modifier additives on burning rate and condensed combustion products parameters of composite aluminized propellant
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
17:10-17:30 Yaroslav Kraft, Ignition and pyrolysis of coal microparticles under the action of pulsed laser radiation
The Federal Research Center of Coal and Coal Chemistry SBRAS, Kemerovo
   
18:00-19:30 Welcome Mixer, ITC Green (lawn in front of ITC)

 

  Chemical Kinetics and Spectroscopy
Chair: Alexey Baklanov
14:30-14:50 Vasily Kaichev, In situ XPS and PM IRRAS study of methanol and ethanol oxidation over Pt(111)
Boreskov Institute of Catalysis SBRAS, Novosibirsk
14:50-15:10 Stanislav Chizhik, Photo-reversibility and wavelength dependence of excited intermediates in nitro-nitrito linkage isomerization of [Co(NH3)5NO2]Cl(NO3) crystals unveiled by photomechanical response
Institute of Solid State Chemistry and Mechanochemistry SBRAS, Novosibirsk
15:10-15:30 Ivan Pozdnyakov, New approaches to determination of the quantum yield of hydroxyl radical generation and its reactivity with persistent contaminants
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
15:30-15:50 Igor Melnikov, Thermal Stability of Dinitrotriazolopyridines and Dinitrobenzotriazoles: Interplay of Thermal Analysis and Computational Chemistry
Semenov Federal Research Center for Chemical Physics RAS, Moscow
15:50-16:10 Coffee break
  Chemical Kinetics and Spectroscopy
Chair: Evgeni Glebov
16:10-16:30 Irina Sokolova (Online), The impact of excilamps radiation on the photodegradation of some phenol derivatives
National Research Tomsk State University, Tomsk
16:30-16:50 Alexey Baklanov, Nature of Compensation Law and “Exotic” Arrhenius Parameters in Denaturation of Proteins
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
16:50-17:10 Alexandra Pyryaeva, UV-photoexcitation of oxygen-isoprene collision complexes as a source of singlet oxygen
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
17:10-17:30 Denis Poydashev (Online), Structure of mixed molecular clusters and its effect on laser induced intracluster dynamics
Institute of Spectroscopy RAS, Troitsk
   
18:00-19:30 Welcome Mixer, ITC Green (lawn in front of ITC)

 

  Magnetic Resonance Spectroscopy and Magnetic Field Effects
Chair: Olesya Krumkacheva
14:30-14:50 Oleg Anisimov, EPR spectra detection by heat release using PVDF films
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
14:50-15:10 Natalia Chumakova, Capability of spin probe technique in determining of molecular organization of graphite oxide materials
Semenov Federal Research Center for Chemical Physics RAS, Moscow
15:10-15:30 Yuri Tsentalovich, NMR-based quantitative metabolomics of biological tissues
International Tomography Center SBRAS, Novosibirsk
15:30-15:50 Alexandra Yurkovskaya, Kinetic evidence for the transiently shifted acidity constant of histidine linked to paramagnetic tyrosine probed by intramolecular electron transfer in oxidized peptides
International Tomography Center SBRAS, Novosibirsk
15:50-16:10 Coffee break
  Magnetic Resonance Spectroscopy and Magnetic Field Effects
Chair: Leonid Kulik
16:10-16:30 Vsevolod Borovkov, Spin statistical factor in the reaction of distant electron transfer
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
16:30-16:50 Yuri Kandrashkin, Dynamic equilibrium in photoexcited molecular systems
Zavoisky Physical-Technical Institute RAS, Kazan
16:50-17:10 Ruslan Zaripov, Endohedral fullerene Sc2@C80(CH2Ph) as a standard sample for field calibration
Zavoisky Physical-Technical Institute RAS, Kazan
17:10-17:30 Ekaterina Kunitsyna (Online), Functionalization of Er3+ single-ion magnet using ferromagnetic microparticles
Institute of Problems of Chemical Physics RAS, Chernogolovka
   
18:00-19:30 Welcome Mixer, ITC Green (lawn in front of ITC)

 

  Session chair: Sergey Aldoshin
09:00-09:40 Elena Bagryanskaya, Triarymethyl radical and its applications
Vorozhtsov Novosibirsk Institute of Organic Chemistry SBRAS, Novosibirsk
09:40-10:00 Nikolay Polyakov, Stereoselectivity of photoinduced interaction of chiral drug S-ketoprofen with enantiomers of tryptophan in phospholipid membranes
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
10:00-10:20 Olesya Krumkacheva, Photoexcited triplet states as spin labels: methodology aspects for pulsed dipolar EPR spectroscopy and application to biomolecules
International Tomography Center SBRAS, Novosibirsk
10:20-10:40 Nina Gritsan, First-principles relativistic calculations of the magnetic properties of lanthanide complexes: are quantitative predictions possible?
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
10:40-11:00 Coffee break
  Session chair: Matvey Fedin
11:00-11:30 Sergey Aldoshin, Targeted design of polyfunctional materials for spintronics and molecular electronics
Institute of Problems of Chemical Physics RAS, Chernogolovka
11:30-12:10 Yulia Gorbunova, Magnetic materials based on sandwich lanthanide complexes with phthalocyanines
Kurnakov Institute of General and Inorganic Chemistry RAS, Frumkin Institute of Physical Chemistry and Electrochemistry RAS, Moscow
12:10-12:30 Eduard Fel'dman, Calculations on a quantum computer performed at IPCP RAS
Institute of Problems of Chemical Physics RAS, Chernogolovka
12:30-12:50 Andrei Palii, Spin effects in molecular quantum cellular automata
Institute of Problems of Chemical Physics RAS, Chernogolovka
12:50-13:00 Conference photo, in front of “Dom Uchenykh”
13:00-14:30 Lunch break

 

  Quantum and Theoretical Chemistry
Chair: Nikita Lukzen
14:30-14:50 Svetlana Laletina, Size-dependent activity of platinum nanoparticles: Theoretical insights from CO adsorption and methanol dehydrogenation
Institute of Chemistry and Chemical Technology SBRAS, Krasnoyarsk
14:50-15:10 Vitaliy Morozov, Jahn-Teller Exchange Clusters in "Breathing” Crystals. Theory of Thermo- and PhotoInduced Spin Crossover Like Transitions
International Tomography Center SBRAS, Novosibirsk
15:10-15:30 Pavel Frantsuzov, Quantitative theoretical model of single quantum dot blinking
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
15:30-15:50 Anatoly Ivanov, Charge transfer symmetry breaking in excited quadrupolar molecules in protic solvents
Volgograd State University, Volgograd
15:50-16:10 Coffee break
  Quantum and Theoretical Chemistry
Chair: Nina Gritsan
16:10-16:30 Elena Shor, Palladium atoms and clusters at ceria nanoparticles: a DFT study
Institute of Chemistry and Chemical Technology SBRAS, Krasnoyarsk
16:30-16:50 Olga Syzgantseva, Targeted electronic structure modification in catalysis: a case study of dual-metal catalyst for CO hydrogenation
Lomonosov Moscow State University, Moscow
16:50-17:10 Stanislav Fedorenko, Kinetics of Polaron Capture by Traps in a Lithium Niobate Crystal
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
17:10-17:30 Irina Mirzaeva, Theoretical Study of Conductance through Monoatomic Nanowires
Nikolaev Institute of Inorganic Chemistry SBRAS, Novosibirsk

 

  Combustion and Energetic Materials
Chair: Oleg Glotov
14:30-14:50 Denis Knyazkov, Kinetics and mechanism of thermal decomposition of triphenyl phosphate in flow reactor
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
14:50-15:10 Ksenia Osipova, Experimental and numerical study of the structure of NH3/H2/O2/Ar flames at elevated pressures
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
15:10-15:30 Vladimir Gordeev, Effect of prescription configuration on properties nanothermite composition Bi2O3/Al/1Me-3H
Institute for Problems of Chemical and Energetic Technologies SB RAS, Biysk
15:30-15:50 Leonid Fershtat, Energetic polynitrogen heterocycles: synthesis and performance
Zelinsky Institute of Organic Chemistry RAS, Moscow
15:50-16:10 Coffee break
  Chemical Physics in Biology and Medicine
Chair: Tatyana Leshina
16:10-16:30 Olesya Pokidova, Glutathione and albumin as the main blood components involved in the transformation of nitrosyl iron complexes
Institute of Problems of Chemical Physics RAS, Chernogolovka
16:30-16:50 Igor Kirilyuk, Reduction-Resistant Nitroxides
Vorozhtsov Novosibirsk Institute of Organic Chemistry SBRAS, Novosibirsk
16:50-17:10 Irina Faingold (Online), In vitro studies of antidiabetic potential of nitrosyl iron complex with thiosulfate ligands
Institute of Problems of Chemical Physics RAS, Chernogolovka
17:10-17:30 Vasily Ptushenko, Prediction of the pH range of the PsbS-dependent photoprotective response in chloroplasts of Lobosphaera incisa
Belozersky Institute of Physico-Chemical Biology MSU, Emanuel Institute of Biochemical Physics RAS, Moscow

 

  Spintronics
Chair: Yulia Gorbunova
14:30-14:50 Matvey Fedin, Spin state switching in copper-nitroxide based molecular magnets using the low-energy photons
International Tomography Center SBRAS, Novosibirsk
14:50-15:10 Aleksandr Akimov, Effect of Spin-Orbit Coupling on the Sign of Magnetic Anisotropy of Quintet Dinitrenes
Institute of Problems of Chemical Physics RAS, Chernogolovka
15:10-15:30 Mikhail Kiskin, Single ion magnets based on cobalt(II) carboxylate complexes
Kurnakov Institute of General and Inorganic Chemistry RAS, Moscow
15:30-15:50 Nataliya Spitsyna (Online), Anionic spin-crossover complex of Fe(III) with space symmetry transition and thermal hysteresis around room temperature
Institute of Problems of Chemical Physics RAS, Chernogolovka
15:50-16:10 Coffee break
  Spintronics
Chair: Matvey Fedin
16:10-16:30 Maxim Chegerev (Online), Magnetic properties of cobalt dioxolene complexes with tetradentate N-donor base
Institute of Physical and Organic Chemistry, Southern Federal University, Rostov-on-Don
16:30-16:50 Maksim Faraonov, Multinuclear complexes of metal phthalocyanines and related macroheterocycles with transition metals and clusters
Institute of Problems of Chemical Physics RAS, Chernogolovka
16:50-17:10 Anna Kazakova, Effect of dihalide substituents on crystal structure and magnetic properties of cation [MnIII(3,5-diHal-sal2323)]+ complexes with BPh4 anion
Institute of Problems of Chemical Physics RAS, Chernogolovka
17:10-17:30 Lyubov Nikolenko (Online), Paramagnetic quantum dots InP@ZnS, doped with manganese ions
Institute of Problems of Chemical Physics RAS, Chernogolovka

 

  Magnetic Resonance Spectroscopy and Magnetic Field Effects
Chair: Victoriya Syryamina
14:30-14:50 Sergey Veber, X-band EPR spectrometer based on MW bridge with 300 W solid-state amplifier and AWG unit
International Tomography Center SBRAS, Novosibirsk
14:50-15:10 Alexandra Svyatova, 3D 15N visualization of a drug hyperpolarized by SABRE approach
International Tomography Center SBRAS, Novosibirsk
15:10-15:30 Alexey Kiryutin, PHOTO-SABRE Polarization on trans-Azobenzene using Parahydrogen under Light
International Tomography Center SBRAS, Novosibirsk
15:30-15:50 Tatiana Gavrilova, Li3V2(PO4)3-based composites as potential cathode materials for lithium-ion batteries: ESR measurements
Zavoisky Physical-Technical Institute RAS, Kazan
15:50-16:10 Coffee break

 

P001

Shirin Berdybaeva, Thin-film laser sensor for detection ammonia and hydrogen chloride vapor , Tomsk State University, Tomsk

P002

Nadezhda Bezlepkina, Spectral properties of bromocresol purple , National Research Tomsk State University, Tomsk

P003

Dr. Alexandr Bogomolov, The formation of chemically bonded argon via photoexcitation of Ar-I2 van der Waals complex , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P004

Dr. Mark Bushuev, Proton transfer processes and luminescence of ESIPT-capable zinc(II) complexes with imidazole and pyrimidine ligands , Nikolaev Institute of Inorganic Chemistry SB RAS, Novosibirsk

P005

Dr. Galina Dultseva, Unraveling the Mechanism of Gas-to-Particle Conversion in Lower Troposphere: Trap or Trace? , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P006

Kirill Ershov, Satturation effect of secondary emission coefficient on mcp-based multipliers in mass-spectrometry , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P007

Maksim Geniman, Investigation of degenerate electron exchange reactions involving short-lived radicals by the method of time-resolved CIDNP , International Tomography Center SB RAS, Novosibirsk

P008

Dr. Yuriy Glazachev, Properties of newly synthesized sterically shielded nitroxides as the potential spin probes in biological researches, Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P009

Dr. Evgeni Glebov, Photochemistry of sodium thiosulfate in aqueous solutions: a lot of radicals , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P010

Polina Kaletina, Study of polymerization of fluorine monomer (1-(2,3,4,5,6-pentafluorophenyl)prop-2-en-1-one), Vorozhtsov Novosibirsk Institute of Organic Chemistry SB RAS, Novosibirsk

P011

Dr. Anna Matveeva, Ways of mechanical energy in cellulose: a simple study , Institute of Solid State Chemistry and Mechanochemistry SB RAS, Novosibirsk

P012

Alexander Mikheylis, Photochemical Processes of Nickel(II) Xanthate Complex in CCl4 , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P013

Alexey Nazarov, Modelling ultrafast fluorescence dynamics: dependence of the solvent response dynamics on the fluorophore nature , Volgograd State University, Volgograd

P014

Mikhail Novikov, Mechanism of UVC photodegradation of carbamazepine in aqueous solutions, Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P015

Dr. Dmitriy Parkhomenko, The Kinetic Solvent Effect on 1,3-Dipolar Cycloaddition of 2,2,5,5-Tetramethyl-3-imidazoline-3-oxide-1-oxyl, Vorozhtsov Novosibirsk Institute of Organic Chemistry SB RAS, Novosibirsk

P016

Eduard Podshivaylov, Presence of Maximal Characteristic Time in Photoluminescence Blinking of MAPbI3 Perovskite , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P017

Vladislav Rogoveshko, Experimental measurement of the van der Waals binding energy in (Xe)n-O2 complexes with velocity map imaging technique , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P018

Dr. Andrey Shernyukov, Addition of Br2 to a triple bond: radical rather than ionic mechanism , Vorozhtsov Novosibirsk Institute of Organic Chemistry SB RAS, Novosibirsk

P019

Aleksey Taratayko, Study of 4-nitrophenol reduction over graphene oxide modified with Ag and CeO2 nanoparticles by in situ UV-vis spectroscopy , Tomsk State University, Tomsk

P020

Grigory Zhdankin, Photochemistry of [IrCl6]3- complex in aqueous solutions , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P021

Dr. Denis Baranov, Preparation of spin-labeled ibuprofen and its interaction with 1-palmitoyl-2-oleoyl-sn-glycero-3-phosphocholine bilayer , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P022

Anna Gaydamaka, Salts of guanine and xanthine: high-pressure and low-temperature study, Boreskov Institute of Catalysis SB RAS, Novosibirsk

P023

Vladimir Koshman, Lipid peroxidation processes involving thiosemicarbazones , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P024

Eugenia Nemova, The effect of terahertz radiation on the transport characteristics of albumin: binding with metal ions , Institute of Laser Physics SB RAS, Novosibirsk

P025

Nataliya Osik, Reduced Nicotinamide Adenine Dinucleotide is the Natural UV Filter of the Bird Eye Lens , International Tomography Center SB RAS, Novosibirsk

P026

Mariia Plokhotnichenko, Investigation of the antibacterial action of silver nanoparticles after inhalation delivery in laboratory mice, Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P027

Alena Pudova, Study of Self-Associates of Polysaccharide Macromolecules in Aqueous Solutions by Dynamic Light Scattering, Institute of Solid State Chemistry and Mechanochemistry SB RAS, Novosibirsk

P028

Dr. Olga Snytnikova, NMR based metabolomic profiling of brain in rat model of Alzheimer’s disease , International Tomography Center SB RAS, Novosibirsk

P029

Dr. Olga Snytnikova, Quantitative metabolomic profiling of blood serum during the autophagy modulation by NMR spectroscopy , International Tomography Center SB RAS, Novosibirsk

P030

Anastasiya Yazikova, Study of the stability of ZIF-8 particles in some buffers and physiological media., International Tomography Center SB RAS, Novosibirsk

P031

Dr. Tatyana Bolshova, The effect of diffusion on the combustion of a sphere of polymethyl methacrylate in air , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P032

Dr. Anatoli Chernov, stimation of the characteristic time scale of physicochemical processes in a flame by the PIV , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P033

Tigran Khoranyan, 3-(4'-R-3'-Furazanyl)-5-(nitropyrazolyl)-1,2,4-oxadiazoles – a new class of HEDMs., Zelinsky Instituteof Organic Chemistry RAS, Moscow

P034

Dr. Alexander Larin, Thermally stable and high-performance energetic materials based on the azo-bridged bifuroxan core, Zelinsky Institute of Organic Chemistry RAS, Moscow

P035

Maria Savastyanova, Synthesis and study of properties of ZrO2-based catalysts , Institute of Technical Chemistry UB RAS, Perm

P036

Egor Shishkin, Discharge setup for generation and study of plasmoid above the water surface: first results , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P037

Ivan Sorokin, A pocket model with a tetrahedral cell for aluminum agglomeration in composite propellants , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P038

Dr. Vyacheslav Teslenko, Influence of forming spark plasmoids on kinetics of propane-oxygen mixture combustion in a closed volume , Lavrentyev Institute of Hydrodynamics SB RAS, Novosibirsk

P039

Dmitry Aleshin, Ligands effects on the magnetic anisotropy in hetero/homoleptic cobalt(II) complexes by NMR spectroscopy and quantum chemical calculations, Nesmeyanov Institute of Organoelement Compounds RAS, Moscow

P040

Alina Arkhipova, Photochemical properties of thiosemicarbazones and its chelate complexes, Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P041

Dr. Simon Babenko, Influence of metal ions on the radical yield in photochemical reactions involving quinone-chelators , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P042

Olga Bakulina, Validation of structural grounds for anomalous molecular mobility in ionic liquid glasses , International Tomography Center SB RAS, Novosibirsk

P043

Egor Blinov, The study of the oxidation mechanism of 5-hydroxymethylfurfurol by NMR spectroscopy, Tomsk State Unidersity, Tomsk

P044

Aleksandr Efremov, Shaping of MOFs: optimization of ZIF-8 composites upon EPR control, International Tomography Center SB RAS, Novosibirsk

P045

Dr. Tatiana Gavrilova, Magnetic properties of CaCu3Ti4O12: Fe solid solutions , Zavoisky Physical-Technical Institute of FRC Kazan Scientific Center RAS, Kazan

P046

Timur Ivanenko, Study of the 13С NMR chemical shifts of nitrobenzene in the acid mixtures , Institute of Chemistry and Chemical Technology SB RAS, Krasnoyarsk

P047

Mikhail Kolokolov, Shaped EPR pulse techniques with different type of spin labels , International Tomography Center SB RAS, Novosibirsk

P048

Zoya Lashchinskaya, MAS NMR spectroscopy for acidity characterization and olefin reaction monitoring on Zn modified zeolites , Boreskov Institute of Catalysis SB RAS, Novosibirsk

P049

Dr. Konstantin Lomanovich, EPR study of stable bicyclic functionalized nitroxides: aza-nortropinone-5-methyl-3-oxo-6,8-dizabicyclo[3.2.1]-6-octane 8-oxyls, Vorozhtsov Novosibirsk Institute of Organic Chemistry SB RAS, Novosibirsk

P050

Dr. Ilya Magin, Solid state photo-CIDEP in chiral linked systems , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P051

Anna Mastova, Photoinduced oxidation of lipid membrane in the presence of nonsteroidal anti-inflammatory drug ketoprofen , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P052

Dr. Anna Matveeva, Nitroxide radicals in starch films: structure-feature correlations , Institute of Solid State Chemistry and Mechanochemistry SB RAS, Novosibirsk

P053

Dr. Anatoly Melnikov, Atomize: open source modular software for working with scientific devices and combining them into a spectrometer , International Tomography Center SB RAS, Novosibirsk

P054

Dr. Anatoly Melnikov, Temperature jump spectroscopy under pulsed THz radiation: a way to measure T1 of magnetically concentrated substances , International Tomography Center SB RAS, Novosibirsk

P055

Dr. Olga Morozova, Time-resolved CIDNP characterization of kynurenic acid radicals generated in photoinduced reactions with tryptophan and tyrosine , International Tomography Center SB RAS, Novosibirsk

P056

Dr. Dmitry Pavlov, The reduction of Ag(I) by N,N-bis(silatranylmethyl)amines, EPR study., Irkutsk Institute of Chemistry SB RAS, Irkutsk

P057

Dr. Artem Poryvaev, Blatter-Radical-Grafted Mesoporous Silica as Prospective Nanoplatform for Gas Sorption and Spin Manipulation, International Tomography Center SB RAS, Novosibirsk

P058

Bogdan Rodin, An analysis of DNP cross-talk experiments for several nuclei , International Tomography Center SB RAS, Novosibirsk

P059

Arkady Samsonenko, Crystallization of paramagnetic compounds in the gradient magnetic field of a superconducting magnet , International Tomography Center SB RAS, Novosibirsk

P060

Natalya Sannikova, Multicenter EPRbased approach for the study the localization of photosensitizers in biomolecules, International Tomography Center SB RAS, Novosibirsk

P061

Irina Shilova, Molecular mobility of nanocellulose gels studied by paramagnetic probe method, Institute of Problems of Chemical Physics RAS, Chernogolovka

P062

Dr. Ivan Skovpin, Anchored complexes of rhodium and iridium in the hydrogenation of alkynes and olefins with parahydrogen , International Tomography Center SB RAS, Novosibirsk

P063

Anna Smorygina, DEER of Spin-Labeled Stearic Acids in Model Phospholipid Membranes Reveals Alternative Cluster Formation in Two Opposing Leaflets , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P064

Aleksandr Snadin, Constant adiabaticity inverting pulses, International Tomography Center SB RAS, Novosibirsk

P065

Anna Spitsyna, ZIF-8 nanoparticles stability in cell culture media , Vorozhtsov Novosibirsk Institute of Organic Chemistry SB RAS, International Tomography Center SB RAS, Novosibirsk

P066

Sergey Sviyazov, Study of the features of hydrogenation reactions of unsaturated hydrocarbons with parahydrogen, International Tomography Center SB RAS, Novosibirsk

P067

Victoria Syryamina, Comparative study of membrane-active trichogins in lipid membranes, Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P068

Viktor Timoshnikov, Redox activity of quinone-chelator Q1 and its chelate complexes with iron ions in cancer cells media. EPR study , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P069

Ivan Trofimov, 1H and 19F NMR Signal Enhancement Enabled by Spin Polarization-Induced NOE and Parahydrogen-Induced RASER , International Tomography Center SB RAS, Novosibirsk

P070

Sergey Tumanov, Development and characterization of impulse THz heating method using EPR of magnetoactive compounds , International Tomography Center SB RAS, Novosibirsk

P071

Dr. Yulia Vosel, Application of the EPR method in studying of the Mn behavior during the diagenesis of lacustrine carbonate sediments , Sobolev Institute of Geology and Mineralogy SB RAS, Novosibirsk

P072

Stanislav Yakushkin, Electron spin resonance in situ study of Ni catalyst in catalytic transfer hydrogenation reaction conditions , Boreskov Institute of Catalysis SB RAS, Novosibirsk

P073

Alexey Anikeenko, Volumetric properties of binary mixtures of carbon tetrachloride with tert-butyl alcohol: a molecular dynamics simulation study , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P074

Dr. Alexey Chichinin, Motion of He, Ne, and Ar atoms and HF molecules inside C60 cage, Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P075

Mikhail Plekhanov, Probing the Structural Mobility of UiO-66 (Zr) MOF in the Presence of Guest Molecules by Means of 2H NMR Spectroscopy, Boreskov Institute of Catalysis SB RAS, Novosibirsk

P076

Elena Yakush, The molecular dynamics study of a dioxadet drug properties in water , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P077

Vasilisa Anikeeva, Organic cation dynamics and spectral features in hybrid metal halide perovskites , Institute of Spectroscopy RAS, Troitsk

P078

Dr. Yuri Fedorov, New heterobimetallic ruthenium(II) complex with imidazo[4,5-f][1,10]phenanthroline-based ligand: synthesis, optical and electrochemical properties, Nesmeyanov Institute of Organoelement Compounds RAS, Moscow

P079

Danil Nevostruev, Thienonaphtalimides as promising additive into organic solar cells , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P080

Alexander Steparuk, New D-π-A compounds as electron transport materials for perovskite solar cells, Postovsky Institute of Organic Synthesis UB RAS, Yekaterinburg

P081

Olga Ustimenko, Building block based on 4,4-bis(2-ethylhexyl)-4H-cyclopenta[2,1-b:3,4-b']dithiophene – approach to the novel effective photovoltaic materials, Zelinsky Institute of Organic Chemistry RAS, Moscow

P082

Dr. Mikhail Uvarov, Tetraazapyrene functionalized nitroxide radical TEMPO and its application in polymer:fullerene photovoltaic cells, Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P083

Alexandr Dubok, Bending crystal phenomena: computational insight, Institute of Solid State Chemistry and Mechanochemistry SB RAS, Novosibirsk

P084

Alexander Kipriyanov, Integral Encounter Theory (IET) of the reversible reaction A + A C, taking into account the force interaction between the reactants , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P085

Alexander Kipriyanov, Non-Markovian kinetic effects in the liquid-phase reaction A + A C , Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P085a

Dr. Svetlana Laletina, Influence of subsurface carbon on methane oxidation on Pd(100) , Institute of Chemistry and Chemical Technology SB RAS, Federal Research Center “Krasnoyarsk Science Center SB RAS”, Krasnoyarsk

P086

Dr. Nikolai Lavrik, IR spectroscopic study and ab initio calculations of the formation of h-complexes of 1,2,3- benztriazole with proton acceptor molecules, Voevodsky Institute of Chemical Kinetics and Combustion SB RAS, Novosibirsk

P087

Dr. Sergey Mamylov, Modeling of the glucose into 1,6-anhydro-beta-D-glucopyranose transformation., Institute of Solid State Chemistry and Mechanochemistry SB RAS, Novosibirsk

P088

Dr. Anton Nizovtsev, Electronic structure of halogen-substituted zinc phthalocyanines, Nikolaev Institute of Inorganic Chemistry SB RAS, Novosibirsk

P089

Dr. Denis Rychkov, Computational study of elastic, brittle and plastic 4-bromophenyl 4-bromobenzoate crystals via molecular mechanics approach, Institute of Solid State Chemistry and Mechanochemistry SB RAS, Novosibirsk

P090

Dr. Denis Rychkov, Determination of thermodynamic stability of pTol2S2 polymorphs at high pressures using computational techniques, Institute of Solid State Chemistry and Mechanochemistry SB RAS, Novosibirsk

P091

Kristina Smirnova, Magnetostructural correlations in magnetoactive chain-polymer Cu(II) complexes with alkyl-pyridyl-substituted nitronyl nitroxides, International Tomography Center SB RAS, Novosibirsk

P092

Dr. Ruslan Zhachuk, Dynamics of Sn adatoms at the single steps on the Si(111)-sqrt(3)xsqrt(3)-Sn surface , Institute of Semiconductor Physics SB RAS, Novosibirsk

P093

Dr. Ruslan Zhachuk, Si(111) strained layers structure on Ge(111) surface , Institute of Semiconductor Physics SB RAS, Novosibirsk

P094

Maxim Bakhmetiev, Frequency of magnetization reversal of grains NiFe and IrMn in exchange-biased thin films NiFe/Cu/IrMn , Institute of Problems of Chemical Physics RAS, Chernogolovka

P095

Maxim Mikhailenko, Anionic compounds of hexaazatriphenylene-based ligands: synthesis, structure and properties , Institute of Problems of Chemical Physics RAS, Chernogolovka

P(online)_01

Prof. Galina Loukova, LMCT states of sophisticated group 4 metallocene dicarboranyls , Institute of Problems of Chemical Physics RAS, Chernogolovka

P(online)_02

Prof. Victor Luzhkov, A DFT study of decomposition of dinitrosyl iron complex Fe(NO)2(SCH2)2+ in water , Institute of Problems of Chemical Physics RAS, Chernogolovka

P(online)_03

Prof. Yauheni Kasandrovich, Peculiarities of HCl sorption from air by weak base anion exchanger with ethylenediamine functional groups: experimental study and DFT simulation , Institute of Physical and Organic Chemistry of the National Academy of Sciences of Belarus, Minsk

P(online)_04

Dr. Alexey Kozlov, Perylene-(cyanine dye) dyad as NIR agent for theranostics , Institute of Problems of Chemical Physics RAS, Chernogolovka

P(online)_05

Dr. Konstantin Rutkowski, Сryospectroscopic and ab initio studies of noncovalent interactions between sevoflurane and selected acceptor-targets , Saint Petersburg State University, Saint Petersburg

P(online)_06

Dr. Andrey Starikov, Computer Modeling of Polyspin Organic Molecules Based on Bis-Triangulenes and Stable Radicals , Institute of Physical and Organic Chemistry, Southern Federal University, Rostov-on-Don


P(online)_07

Marsel Arifullin, Elementary operations of quantum computation algorithms by using phase-modulated microwave pulses, Orenburg University, Orenburg

P(online)_08

Nikolai Baranov, The quantum-chemical modeling of adamantane olefination with ethylene, propylene, butylene , Peoples' Friendship University of Russia, Moscow

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En:

P(online)_09

Karen Egiazaryan, On the accuracy of DFT methods for calculating the activation characteristics of the Pd-catalyzed allylation of norbornadiene , MIREA - Russian Technological University, Moscow

P(online)_10

Maxim Grigoriev, Structure and properties of the EuErCuTe3: ab initio calculation, University of Tyumen, Tyumen

P(online)_11

Ilya Nechaev, Effective Multicomponent Approach to Indolizin-1-ols: Chemical and Spectral Particularities of the Products, Zelinsky Instituteof Organic Chemistry RAS, Moscow

P(online)_12

Arina Petukhova, Spectral properties and kinetics of interaction with the fluoride ion of aryl-substituted boron subphthalocyanines , Lomonosov Moscow State University, Moscow

P(online)_13

Natalia Potapova, The influence of moderate magnetic field on the generation of radicals by mixture of some choline derivative with hydroperoxides , Semenov Federal Research Center for Chemical Physics RAS, Moscow

P(online)_14

Alexander Shmakov, EPR study of nitrenephenylverdazyl radicals, Lomonosov Moscow State University, Moscow

 

  Session chair: Elena Bagryanskaya
09:00-09:40 Roald Hoffmann (Online), The chemical imagination at work in very tight places
Cornell University, USA
09:40-10:20 Igor Lomonosov, Chemical physics of extreme states of matter, equations of state for metals, Moon and asteroid materials
Institute of Problems of Chemical Physics RAS, Chernogolovka
10:20-10:40 Nikita Muravyev, Screening of Energetic Cocrystals using Thermal Analysis
Semenov Federal Research Center for Chemical Physics RAS, Moscow
10:40-11:00 Coffee break
  Session chair: Victor Bagryansky
11:00-11:40 Alexander Kokorin, Spin exchange in biradicals as a model to study long-range interactions
Semenov Federal Research Center for Chemical Physics RAS, Moscow
11:40-12:00 Igor Koptyug, Chemistry of nuclear spin isomers of symmetric molecules for new scientific and practical applications
International Tomography Center SBRAS, Novosibirsk
12:00-12:20 Vitaliy Berdinskiy (Online), Nuclear Spin Dependent Enzymatic Synthesis of ATP in Strong Magnetic Fields
Orenburg University, Orenburg
12:20-13:00 Vilen Azatyan (Online), Features of the physicochemical mechanism of combustion, explosion and gas detonation reactions, development of chemical methods of process control
Scientific Research Institute for System Analysis RAS, Moscow
13:00-14:30 Lunch break

 

  Chemical Kinetics and Spectroscopy
Chair: Victor Plyusnin
14:30-14:50 Alexander Pomadchik, Kinetics of the template synthesis and acidic decomposition of the methylboron-capped iron(II) tris-dioximate clathrochelates: dramatic changes in the kinetic parameters and schemes in passing from six- to eight-membered alicyclic alpha-dioximes
Nesmeyanov Institute of Organoelement Compounds RAS, Moscow
14:50-15:10 Anna Kurokhtina (Online), Spectroscopic evidence for the substantial catalyst deactivation under “ligand-free” Suzuki-Miyaura reaction with aryl chlorides
Irkutsk State University, Irkutsk
15:10-15:30 Galina Loukova (Online), Ligand-to-metal charge transfer excited states in organometallics
Institute of Problems of Chemical Physics RAS, Chernogolovka
15:30-15:50 Sergey Khantimerov (Online), Nanostructured germanium formed by ion implantation method as an anode for lithium-ion batteries
Zavoisky Physical-Technical Institute RAS, Kazan

 

  Combustion and Energetic Materials
Chair: Vladimir Zarko
14:30-14:50 Nikolay Shilkin, Proton radiography of explosively driven targets and static objects
Institute of Problems of Chemical Physics RAS, Chernogolovka
14:50-15:10 Denis Nurmukhametov, Explosive decomposition of high explosives with inclusions of ultrafine metal particles under the influence of pulsed laser radiation
The Federal Research Center of Coal and Coal Chemistry SBRAS, Kemerovo
15:10-15:30 Valeriy Volkov, Study of laser pyrolysis of coals with analysis of gaseous products
The Federal Research Center of Coal and Coal Chemistry SBRAS, Kemerovo
15:30-15:50 Aleksandr Pyryaev, Gaseous products of the methane pyrolysis in laser initiated Cr/Al2O3 nanoparticle evaporation process in methane-argon medium
Boreskov Institute of Catalysis SBRAS, Novosibirsk
15:50-16:10 Viacheslav Prokopenko (Online), Features of flame propagation caused by heterogeneous reactions of intermediate particle
Merzhanov Institute of Structural Macrokinetics and Materials Science RAS, Chernogolovka

 

  Magnetic Resonance Spectroscopy and Magnetic Field Effects
Chair: Nikita Lukzen
14:30-14:50 Alexander Doktorov, The influence of spin relaxation and locally strong spin exchange on magneto-spin effects in radical pairs in high magnetic fields
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
14:50-15:10 Peter Purtov, Reaction operators for radical pairs
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
15:10-15:30 Alexander Khudozhitkov, 2H NMR study of hydrogen bond dynamics and phase transition in a model ionic liquid electrolyte
Boreskov Institute of Catalysis SBRAS, Novosibirsk
15:30-15:50 Ivan Zhukov (Online), Field dependence of 1H optical nuclear polarization in organic molecular crystal powder: experiments and modeling
International Tomography Center SBRAS, Novosibirsk

 

  Session chair: Sergey Dzuba
09:00-09:40 Egor Verbitskiy, SNH-reactions and other cross-dehydrogenative coupling processes for the construction of 1,3-/1,4-diazine-based polycyclic systems
Postovsky Institute of Organic Synthesis UBRAS, Ekaterinberg
09:40-10:10 Nikolay Surovtsev, Low-frequency Raman spectroscopy of phospholipid membranes
Institute of Automation and Electrometry SBRAS, Novosibirsk
10:10-10:40 Lev Krasnoperov, Negative Apparent Activation Energies, V-Shaped Temperature Dependences, and Pressure Dependence of “Simple Metathesis Reactions” with “Negative Barriers”
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
10:40-11:00 Victor Plyusnin, Fast Photophysics Processes and Transient Species in Photochemistry of Ni(S2P(i-Bu)2)2 Complex in CCl4
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
11:00-11:20 Coffee break
  Session chair: Vladimir Razumov
11:20-11:40 Alexander Cheremisin, Sedimentation of soot particles in dark and under illumination in a rarified gas medium
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
11:40-12:00 Vitaly Kiselev, Modern Predictive Quantum Chemical Calculations for Thermochemistry and Decomposition Kinetics of Energetic Materials
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
12:00-12:20 Olga Fedorova (Online), Sensing of nucleic acid and associated cellular components with organic fluorescent chemosensors
Nesmeyanov Institute of Organoelement Compounds RAS, Moscow
12:20-13:00 Kev Salikhov (Online), New vision of spin nutation
Zavoisky Physical-Technical Institute RAS, Kazan
13:00-14:30 Lunch break

 

  Organic Photovoltaics
Chair: Mikhail Uvarov
14:30-14:50 Leonid Kulik, Out-of-phase electron spin echo spectroscopy of short-living charge-transfer state in organic photovoltaic composite of P3HT and semiconducting carbon nanotubes
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
14:50-15:10 Alexandr Bogomolov, Does singlet fission take place in tetracene dimer?
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
15:10-15:30 Alexander Akkuratov (Online), Tuning the hole mobilities in ordered small-molecule semiconductors by side-chain engineering and fluorine substitution
Institute of Problems of Chemical Physics RAS, Chernogolovka
15:30-15:50 Ilya Kuznetsov (Online), Synthesis and photovoltaic properties of novel (X-DADAD)n conjugated polymers with fluorene and phenylene blocks
Institute of Problems of Chemical Physics RAS, Chernogolovka
15:50-16:10 Coffee break
  Molecular Dynamics
Chair: Alexander Cheremisin
16:10-16:30 Nikolai Medvedev, The structure of ionic liquids in terms of intermolecular voids
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
16:30-16:50 Alexandra Kim, Molecular dynamics study of the anticancer drug dioxadet transfer across the lipid membrane DOPC
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
16:50-17:10 Victor Luzhkov (Online), Molecular dynamics, molecular mechanics and DFT modeling of the conformational properties of spin-labeled chitosan in water
Institute of Problems of Chemical Physics RAS, Chernogolovka
17:10-17:30 Bulat Farrakhov (Online), Germanium Nanowires Layer Formed by Ion Implantation and Incoherent-Light Pulse Annealing
Zavoisky Physical-Technical Institute RAS, Kazan
   
19:00-22:00 Conference Dinner, Restaurant “Kukuruzza”, Academpark, Nikolaeva St. 12/2

 

  Combustion and Energetic Materials
Chair: Vitaly Kiselev
14:30-14:50 Igor Valtsifer, Development of fire-extinguishing powder compositions for automatic means of explosion containment
Institute of Technical Chemistry UBRAS, Perm
14:50-15:10 Konstantin Ukhin, The influence of synthesis parameters on the characteristics of MOs/CB composites and their effectiveness for the thermal decomposition of ammonium perchlorate
Institute of Technical Chemistry UBRAS, Perm
15:10-15:30 Ivan Sorokin, Effect of Me/B-powder on ignition and combustion of HEMs
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
15:30-15:50 Denis Nurmukhametov, Influence of dispersion of coal particles on the characteristics of laser ignition
The Federal Research Center of Coal and Coal Chemistry SBRAS, Kemerovo
15:50-16:10 Coffee break
  Combustion and Energetic Materials
Chair: Nikita Muravyev
16:10-16:30 Dmitry Nikolaev, Study of shock compressibility and shock-induced temperature of oxides by Mach cumulative explosive generators
Institute of Problems of Chemical Physics RAS, Chernogolovka
16:30-16:50 Valentina Mochalova, Shock initiation of detonation in heterogeneous explosives based on nitromethane
Institute of Problems of Chemical Physics RAS, Chernogolovka
16:50-17:10 Alexander Utkin, Instability of detonation waves in mixtures of tetranitromethane with methanol and nitrobenzene
Institute of Problems of Chemical Physics RAS, Chernogolovka
17:10-17:30 Ilya Romanchenko, Transfer of soot aerosol of Siberian forest fires in the stratosphere of 2019
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
   
19:00-22:00 Conference Dinner, Restaurant “Kukuruzza”, Academpark, Nikolaeva St. 12/2

 

  Spintronics
Chair: Mikhail Kiskin
14:30-14:50 Denis Korchagin, Evidence of field-assisted slow magnetic relaxation in Cu(II) complexes with pentaheterocyclic triphenodioxazines
Institute of Problems of Chemical Physics RAS, Chernogolovka
14:50-15:10 Maxim Bakhmetiev, Slow relaxation of anomalous Hall effect in GdFeCo/Ir/GdFeCo
Institute of Problems of Chemical Physics RAS, Chernogolovka
15:10-15:30 Ivan Kurganskii, Spin exchange between triplet 3CS and 3LE states in NI-PXZ dyad revealed by TR EPR
International Tomography Center SBRAS, Novosibirsk
15:30-15:50 Valeriya Shtefanets, New erbium (3+) hexafluoroacetylacetonates with spirocyclic photochromes: synthesis, structure, properties
Institute of Problems of Chemical Physics RAS, Chernogolovka
15:50-16:10 Coffee break
  Spintronics
Chair: Alexandra Yurkovskaya
16:10-16:30 Aleksandra Tiunova, [Mn(5-Hal-sal2323)]2[ReCl6] (Hal=Cl, Br): the first Mn(III) molecular complexes to exhibit both spin crossover and single-ion magnet effects
Institute of Problems of Chemical Physics RAS, Chernogolovka
16:30-16:50 Danil Markelov, Adiabatic approach to polarize 15N nuclei with SABRE at high magnetic fields
International Tomography Center SBRAS, Novosibirsk
16:50-17:10 Elizaveta Kononenko, Operando MRI study of a heterogeneous reactor using parahydrogen-induced polarization with antiphase-to-inphase signal shape conversion
International Tomography Center SBRAS, Novosibirsk
17:10-17:30 Maxim Blagov, The X-ray crystallographic and Mössbauer study of the halide salts of [FeIII(3-OMe-Sal2trien)]+ spin-crossover cation
Lomonosov Moscow State University, Moscow
   
19:00-22:00 Conference Dinner, Restaurant “Kukuruzza”, Academpark, Nikolaeva St. 12/2

 

  Molecular Dynamics
Chair: Nikolai Medvedev
09:00-09:20 Evgenii Kadtsyn, Voronoi analysis of solutions volumetric properties
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
09:20-09:40 Vladislav Nichiporenko, Concentration-dependent charge scaling as a simple method of force field correction in MD simulation of aqueous alcohol solutions
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
09:40-10:00 Ekaterina Shelepova, On the reason for the increased solubility of CO2 in [СnMIM][NTf2] ionic liquids
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
10:00-10:20 Vladimir Voloshin, Autocorrelation functions of translational and rotational velocities of water molecules and their spectra in computer models
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
10:20-10:40 Coffee break
  Quantum and Theoretical Chemistry
Chair: Vitaly Kiselev
10:40-11:00 Vladimir Andryushchenko, Modeling of FRET-experiments on protein folding
Institute of Thermophysics SBRAS, Novosibirsk
11:00-11:20 Anton Gabrienko, DFT approach for the calculation of NMR and IR spectral parameters of olefins on Zn-modified zeolites
Boreskov Institute of Catalysis SBRAS, Novosibirsk
11:20-11:40 Ruslan Zhachuk, Pentamer with interstitial atom as the universal building block of (110), (331), (113) silicon and germanium surfaces
Institute of Semiconductor Physics SBRAS, Novosibirsk
11:40-12:00 Denis Rychkov (Online), Computational study of direct chemical phenol glycosylation mechanism
Institute of Solid State Chemistry and Mechanochemistry SBRAS, Novosibirsk
   
12:30-13:10 Farewell, ICKC Conference hall

 

  Chemical Kinetics and Spectroscopy
Chair: Ivan Pozdnyakov
09:00-09:20 Sergey Cherkasov, The 1,3-dipolar cycloaddition to nitrones and thier photorearrangement as activation methods of alkoxyamine hemolysis
Vorozhtsov Novosibirsk Institute of Organic Chemistry SBRA S, Novosibirsk
09:20-09:40 Evgeny Kovalev, Effect of Cu(I) additive on sorption by imidazole based ionic liquids studied by in situ ATR-FTIR spectroscopy
Boreskov Institute of Catalysis SBRAS, Novosibirsk
09:40-10:00 Veronika Semionova, Solvent dependent photochromism and emission of diarylethenes with a π-conjugated push-pull system
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
10:00-10:20 Alexandra Zima, Correlation between the Reactivity and Selectivity of Low-Spin and High-Spin Oxo-Iron(V) Complexes in the Oxidation of (+)-Sclareolide
Boreskov Institute of Catalysis SBRAS, Novosibirsk
10:20-10:40 Coffee break
  Chemical Kinetics and Spectroscopy
Chair: Alexandr Bogomolov
10:40-11:00 Andrey Cherepanov, Experimental and kinetic modeling study of the positive ions in ethylene flames
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
11:00-11:20 Yuliya Zhuravleva, Effect of pH on mechanisms and products of photodamage to tryptophan and tyrosine residues in the free state and a model protein
International Tomography Center SBRAS, Novosibirsk
11:20-11:40 Yury Belikov, Efficiency of the FeEDDS complex in the production of OH radicals
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
11:40-12:00 Yuliya Tyutereva, The use of iron oxalate complexes and potassium persulfate for photodegradation of para-arsanilic acid
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
   
12:30-13:10 Farewell, ICKC Conference hall

 

  Chemical Physics in Biology and Medicine
Chair: Nikolay Polyakov
09:00-09:20 Polina Kononova, Interactions of the antiviral drug glycyrrhizin and coronavirus E-protein with membrane mimetics by solution NMR studies
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
09:20-09:40 Aleksandra Ageeva, Electron and energy transfer processes in linked systems with chiral drugs. Spin chemistry and photochemistry investigation
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
09:40-10:00 Tatyana Kon'kova, Multielemental (boron, gadolinium) nanobiocomposites for multichannel theranostics
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
10:00-10:20 Sergey Valiulin, Aerosol inhalation delivery of ceftriaxone in mice
Voevodsky Institute of Chemical Kinetics and Combustion SBRAS, Novosibirsk
10:20-10:40 Coffee break
  Magnetic Resonance Spectroscopy and Magnetic Field Effects
Chair: Sergey Veber
10:40-11:00 Vitaly Kozinenko, Fast field cycling relaxometry of long-lived spin states to probe weak ligand-protein binding
International Tomography Center SBRAS, Novosibirsk
11:00-11:20 Oleg Salnikov, Mechanistic insight into heterogeneous hydrogenation of methylenecyclobutane with the use of parahydrogen
International Tomography Center SBRAS, Novosibirsk
11:20-11:40 Sergey Ovcherenko, Kinetics of base pair opening-closing process in DNA duplex containing oxoG:C pair and oxoG:A mismatch
Vorozhtsov Novosibirsk Institute of Organic Chemistry SBRAS, Novosibirsk
11:40-12:00 Natalya Fishman, A CIDNP study of the reduction of short-lived thymine radicals by aromatic amino acids
International Tomography Center SBRAS, Novosibirsk
   
12:30-13:10 Farewell, ICKC Conference hall