《结构化学》杂志由中国科学院主管，中国科学院福建物质结构研究所(福州市闽侯上街高新区海西园,中国科学院海西研究院);中国化学会主办的学术性期刊。自创刊以来，杂志始终立足化学科技前沿聚焦国内外化学发展动态，致力于打造集学术研究、技术交流与行业资讯于一体的高端传播平台。
《结构化学》栏目主要设置有有机化学、无机化学、合成化学、结构化学、材料科学、药物化学、晶体学、理论化学等。等多个栏目。杂志选题新颖，视角前瞻，既关注基础理论研究，也重视应用成果，兼顾学术深度与传播广度，具有信息量大、时效性强、实用性突出的特点，荣获 "中国优秀期刊遴选数据库、中国期刊全文数据库（CJFD）、中科双效期刊" 等荣誉。
Nanoclusters Au19Pd and Au19Pt Catalyzing CO Oxidation: a Density Functional Study
关键词：BIMETALLIC CLUSTER CATALYTIC activity CO OXIDATION density functional theory
Quantum Chemistry Study on Benzimidazoledithi Derivatives' Selective Pre-enrichment of Cadmium Cation
关键词：benzimidazoledithi (BDT)derivatives SELECTIVE pre-enrichment GLUTATHIONE CADMIUM ion density functional theory
Theoretical Study on the Reaction Mechanism of o-Aminophenol, Acetic Acidand Phosphorus Oxytrichloride One-pot to Form 2-Methyl Benzoxazole
关键词：O-AMINOPHENOL acetic acid PHOSPHORUS oxytrichloride 2-methyl BENZOXAZOLE density functional reaction mechanism
Theoretical Investigations on the Structural and Electronic Properties of WO3 Polymorphs
关键词：TUNGSTEN TRIOXIDE BAND structure electronic properties DFT
Studies on a Series of Coumarin Derivatives for Anticancer Activity against Breast Carcinoma Cell Line MCF-7 and Their Molecular Design
关键词：3D-QSAR COMFA COMSIA ANTICANCER COUMARIN
Synthesis, Structure and Biological Activities of a Novel Anionic Organotin (IV) Complex {[(p-ClC6H4CH2)Sn(H2O)(Cl)2OCOCH(O)CH(O) CO2Sn(H2O)(Cl)2(p-ClC6H4CH2)]?2(HNEt3)}
关键词：ANIONIC organotin(IV) COMPLEX D-tartaric acid synthesis structure vitro anticancer activity
Surface Modification of Titanium Oxide by Indium for Efficient PhotocatalyticHydrogen Generation
关键词：INDIUM MODIFICATION HYDROGEN GENERATION PHOTOCATALYTIC activity
A Selective Luminescent Acetone Sensing Coordination Polymer Constructed from Zinc(II) Ions and Imidazolyl-bearing Ligands
关键词：luminescence coordination polymer fluorescence QUENCHING ACETONE detection
A New Luminescent Cd(II) Coordination Polymer Constructed with 2-(Carboxymethoxy)benzoic Acid
关键词：crystal structure COORDINATION POLYMER 2-(carboxymethoxy)benzoic acid
Syntheses, Crystal Structures and DNA-binding Properties of Zn(II), Ni(II) and Co(II) Compounds Containing Thiazole Derivatives
关键词：CALF thymus DNA 2-(2-pyridyl)benzothiazole single-crystal structures
