Contents

Journal of Structural Chemistry


Vol. 67, No. 4, 2026


Atomic Charge Distribution and Chemical Bonding in Isolated Molecules of 3,4-Dihydro-1H-Benzo[c][1,2]Thiazine 2,2-Dioxide Derivatives

S.V.Kartashov, A.P.Fedonin, and R.R.Fayzullin p. 713  abstract

Synthesis And Structure of N- and O-Donor Pyridazine-Based Ligands of Various Denticity

M.D.Nafikov, M.D.Taigina, D.Yu.Naumov, A.L.Gushchin, and K.A.Vinogradova p. 726  abstract

Electronic Structure and Elastic Properties of Polymorphic Phases of Lithium Oxothallate (LiTlO2)

E.B.Duginova, Y.M.Basalaev, and N.G.Kravchenko p. 740  abstract

Complexation of 5-(1-pentyl-4-methyl-1,2,3-triazol-4-yl)-6-Methyluracil with Copper Chloride in Organic Solvents

A.A.Pyshkin, E.M.Khamitov, I.E.Alekhina, and S.P.Ivanov p. 755  abstract

Crystal Structures of Double Molybdates Potassium and Cadmium

S.F.Solodovnikov, Z.A.Solodovnikova, E.S.Zolotova, V.N.Yudin, and E.M.Saranchina p. 766  abstract

Copper(I) Thiocyanate Complex with 2-Benzylthio-4-(3,5-dimethyl-1H-pyrazol-1-yl)Pyrimidine: Synthesis, Polymorphism, and Luminescence

S.V.Skvortsova and F.K.Verkhov p. 776  abstract

Binuclear Cadmium(II) Complexes Based on 1,2-bis-{(2,4,6-trimethylphenyl)}Iminoacenaphthene: Synthesis, Structure, and Electrochemical Properties

E.V.Chekhov, I.V.Bakaev, V.I.Komlyagina, A.A.Ulantikov, N.F.Romashev, and A.L.Gushchin p. 787  abstract

Synthesis and Crystal Structure of a New Mixed NH4/Cs Borate (NH4)0.858Cs0.142[B5O7(OH)2]·0.5H2O

Yu.O.Kopylova, S.N.Volkov, S.M.Aksenov, and R.S.Bubnova p. 796  abstract

Coordination Complexes of Cd(II), Cu(II), Zn(II), and Substituted Diimide Ligands: Syntheses, Structural Analyses and Gas Sorption Studies

R.Mahwasane, L.Mbonzhe, N.Chatterjee, and E.Batisai p. 806  abstract

Crystal Growth and Luminescent Characteristics of Li–Ba Fluorides, Borates, and Fluoroborates Doped with REE (REE = Sm, Eu, Tb)

E.A.Simonova, D.M.Khramtsova, A.A.Goreyavcheva, and E.N.Nigmatulina p. 815  abstract

Synthesis, Characterization, and Hirshfeld Surface Analysis of Two Schiff Bases: (E)-3-(((4-iodophenyl)imino)methyl)Benzene-1,2-Diol and (E)-3-(((3-bromo-4-methylphenyl)imino)methyl)-Benzene-1,2-Diol

O.Şimşek, Ş.Atalay, M.Taşdoğan, E.Ağar, H.Bülbül, and S.Kansız p. 827  abstract

tris-Ethylenediamine Complexes of Rhodium(III) and Iridium(III): Synthesis, Crystal Structures, and Formation of Double Complex Salts with Oxalato Cuprate(II)

V.I.Sinitsa, P.S.Smirnov, E.Yu.Filatov, N.V.Kuratieva, P.E.Plyusnin, and S.V.Korenev p. 841  abstract

Switching Colors: Multiple Emission in a Manganese(II) Bromide Compound

A.S.Berezin, A.M.Danilenko, A.S.Sukhikh, B.A.Selivanov, and A.Y.Komarovskikh p. 855  abstract

Synthesis, Characterization and Crystal Structures of N’-(2-hydroxy-4-methoxybenzylidene)-3-Trifluoromethylbenzohydrazide and its Nickel(II) and Iron(III) Complexes with Antibacterial Activity

F.-Y.Wei and W.Liu p. 870  abstract

Molecular and Crystal Structure of 1,2,3-Tribenzylthiobenzene and 1,2-Dibenzylthio-3-Fluorobenzene According to XRD Data and Density Functional Theory Computations

A.A.Buravlev, I.Y.Bagryanskaya, and A.Yu.Makarov p. 882  abstract

Synthesis, Characterization and Crystal Structures of Aroylhydrazones Derived from 4-Hydroxy-3-Nitrobenzaldehyde with Various Hydrazides

Y.Wang, W.Li, and N.Song p. 893  abstract

Structures and Nonlinear Optical Properties of the Functionalized Porphyrin with the Alkalides: a DFT Study

Y.Lu and X.Li p. 903  abstract

Structural Parameters of the Nearest Environment of Ions in Nickel Chloride Aqueous Solutions According to XRD Data

P.R.Smirnov and O.V.Grechin p. 915  abstract

Synthesis and Structure of “Clickable” Boron Difluoride Formazanate

D.N.Konshina, I.A.Lupanova, E.A.Spesivaya, I.V.Sukhno, and V.V.Konshin p. 922  abstract

First Principles Calculations of Structures, Mechanical and Vibrational Properties of Nonlinear Optical LiZnCO3(OH) and NaZnCO3(OH) Crystals

Yu.N.Zhuravlev and E.V.Gvozdikova p. 930  abstract

Crystallization of N-(1-(1-naphthyl)ethyl)-N′-Phenylthiourea: Transferring a Stable Packing Motif from a Racemic Medium to a Homochiral One

L.V.Frantsuzova, D.P.Gerasimova, K.E.Metlushka, K.A.Nikitina, K.A.Ivshin, O.N.Kataeva, and O.A.Lodochnikova p. 948  abstract

Preparation, Spectral, Crystal Structures, Synthons Investigation and Hirshfeld Surface Analysis of Each of a Salt and Cocrystal Derived from Picolinic Acid

R.Gao, S.Chen, S.Jin, Y.Ni, Z.Li, R.Hong, H.Hong, Q.He, and D.Wang p. 958  abstract