Vyacheslav Bryantsev
0000-0002-6501-6594
98 papers found
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Quantum-chemical description of cyclization and recyclization reactions. 27. Electrocyclizations of phenyl and benzannelated derivatives of 1,2,4-triazahexa-1,3,5-triene and 1,2,4-oxadiazahexa-1,3,5-triene
De novo structure-based design of tris-urea tripodal and macrocyclic anion receptors
Influence of Substituents on the Strength of Aryl C−H···Anion Hydrogen Bonds
Using the MMFF94 model to predict structures and energies for hydrogen-bonded urea–anion complexes
Are C−H Groups Significant Hydrogen Bonding Sites in Anion Receptors? Benzene Complexes with Cl-, NO3-, and ClO4-
Conformational Analysis and Rotational Barriers of Alkyl- and Phenyl-Substituted Urea Derivatives
De novo design of urea-based receptors for anions.
Quantum Chemical Semiempirical Approach to the Structural and Thermodynamic Characteristics of Fluoroalkanols at the Air/Water Interface
Transition State for Aggregation and Reorganization of Normal Fatty Alcohols at the Air/Water Interface
Aggregation and re-organization of normal fatty alcohols at the air/water interface
Substituent Effects on Hyperfine Coupling Constants Analyzed in Terms of p-Bound Electron Perturbation Theory
Calculation of thermochemical properties of conjugated radicals
Quantum Chemical Analysis of the Thermodynamics of 2D Cluster Formation of Oddn-Alcohols at the Air/Water Interface
Quantum chemical semi-empirical approach to the thermodynamic characteristics of oligomers and large aggregates of alcohols at the water/air interface
Electronic structure, aromaticity and physicochemical properties of derivatives of carbenic, radical and ionic imidazoles and their oxygen and thioanalogs
Quantum-chemical treatment of cyclization and recyclization reactions: XXV. Skeletal rearrangements of radicals, and lowest triplet-state systems
Quantum-chemical treatment of cyclization and recyclization reactions: XXVI. Effects of substituents in the thermal rearrangement of methylenecyclopropane
Quantum chemical analysis of thermodynamics of the two-dimensional cluster formation at the air/water interface
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