结构化学
  ISSN 0254-5861  CN35-1112/TQ  
 
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1 Quantum Chemistry Based Computational Study on the Conformational Population of a Neodymium Neodecanoate Complex 2016 Vol.35(6):833-838
项曙光;王继叶;孙晓岩 [摘要] ( 174 ) [HTML 0 KB][PDF 942 KB] (358)
2 Internalization of Foreign Ions into Meta-stable Lattices:a Case Study of Transition-metal-doped Brookite 2016 Vol.35(8):1157-1166
黄新松;李莉萍;李广社 [摘要] ( 116 ) [HTML 0 KB][PDF 1905 KB] (298)
3 Theoretical Investigations of the Activation of CO2 on the Transition Metal-doped Cu(100) and Cu(111) Surfaces 2016 Vol.35(5):669-678
邱美;刘禹;吴娟;李奕;黄昕;陈文凯;章永凡 [摘要] ( 112 ) [HTML 0 KB][PDF 1099 KB] (315)
4 A Novel 3D Pillar-layered Co(II)-MOF with (4,8)-Connected Topology: Synthesis,Structure and Magnetic Properties 2016 Vol.35(5):774-780
王晔楠;赵君;王海兵;徐国旺;唐苹 [摘要] ( 107 ) [HTML 0 KB][PDF 643 KB] (171)
5 Organic Cation Effect on the Physical Properties of CH3NH3PbI3 Perovskite from the First-principles Study 2016 Vol.35(8):1297-1305
刘娜;黄楚云;祝林;陈益;徐国旺;楚亮;马新国 [摘要] ( 93 ) [HTML 0 KB][PDF 687 KB] (178)
6 Theoretical Calculation about the High Energy Density Molecules of Nitrate Ester Substitution Derivatives of Prismane 2016 Vol.35(8):1306-1312
李歩通;迟伟杰;李璐琳 [摘要] ( 86 ) [HTML 0 KB][PDF 387 KB] (134)
7 The First Principles Study of Li, Al and Ca Doped Zigzag (7,0) Single Walled Carbon Nanotube 2016 Vol.35(5):731-739
张亚飞;张红 [摘要] ( 82 ) [HTML 0 KB][PDF 795 KB] (173)
8 Self-assembly of a Mixed-valence Cu(I)/Cu(II) Coordination Polymer Derived from a Conformationally Flexible Tripodal Phosphoric Trimide Ligand 2016 Vol.35(5):747-752
弓亚琼;高金伟;米陶清 [摘要] ( 77 ) [HTML 0 KB][PDF 461 KB] (148)
9 Structural, Electronic and Optical Properties of Te-Doped GaAs Nanowires: the First Principles Study 2016 Vol.35(7):993-1001
兰子平;魏相海;王海峰;李权;高涛 [摘要] ( 76 ) [HTML 0 KB][PDF 761 KB] (294)
10 Size Effect on Raman Spectra and Electronic Structure of Glycine-Alanine Oligopeptide chains 2016 Vol.35(8):1289-1296
余敏;孟耀勇 [摘要] ( 75 ) [HTML 0 KB][PDF 546 KB] (100)
11 Crystal Structure, DFT Calculation and Photophysical Studies of a Schiff Base 2016 Vol.35(5):679-686
金凤;张文轩;潘成玉;孙林;苗慧;廖荣宝;陶栋梁 [摘要] ( 73 ) [HTML 0 KB][PDF 1002 KB] (271)
12 Rational Design of Star-shaped Molecules with Benzene Core and Naphthalimide Derivatives End Groups as Organic Light-emitting Materials 2016 Vol.35(12):1811-1818
张立萍;柴万东;靳瑞发 [摘要] ( 73 ) [HTML 0 KB][PDF 383 KB] (213)
13 Pt/FeSnO(OH)5: A Novel Supported Pt Catalyst for Catalytic Oxidation of Benzene 2016 Vol.35(6):889-902
俞瀚;曹周明;魏笑峰;于岩 [摘要] ( 73 ) [HTML 0 KB][PDF 920 KB] (182)
14 [Au(η2-Sn2Sb2)2]3-: a Mixed Group 14/15 Tetrahedral Dimer Bridged by Au 2016 Vol.35(7):1099-1106
潘付兴;李磊娇;孙忠明 [摘要] ( 72 ) [HTML 0 KB][PDF 598 KB] (150)
15 Two Metal-organic Coordination Polymers with Rigid Bis(triazole) Ligand: Assembly,Structures, and Fluorescence Properties 2016 Vol.35(5):765-773
张旭;赵艳琴;王福生;董桂英 [摘要] ( 72 ) [HTML 0 KB][PDF 1328 KB] (170)
16 Synthesis, Crystal Structure, Fluorescent Property and DFT Study of a Novel 1D Polymer [Zn(HMICD)(bpy)]n•2nH2O 2016 Vol.35(9):1420-1426
郭瑞;刘广;张杨;李朝阳;齐靖宇;刘宣文;苏娜 [摘要] ( 72 ) [HTML 0 KB][PDF 494 KB] (110)
17 Theoretical Investigation on the Charge Transport Properties of 2,5-Di(cyanovinyl)-thiophene/furan with the Kinetic Monte Carlo Method 2016 Vol.35(5):687-686
赵蔡斌;葛红光;靳玲侠;张强;尹世伟 [摘要] ( 71 ) [HTML 0 KB][PDF 659 KB] (145)
18 3D-QSAR Studies on 3-Substituted N-Benzhydryl-nortropane Analogs as Nociception Receptor Agonists 2016 Vol.35(9):1319-1327
苗俊秋;何素海;董秀山;梁泰刚;李青山 [摘要] ( 68 ) [HTML 0 KB][PDF 469 KB] (292)
19 Syntheses, Crystal Structures and Antibacterial Activities of Cobalt(Ⅱ) and Manganese(Ⅱ) Complexes with Schiff Base Ligand Derived from Tryptamine 2016 Vol.35(7):1002-1010
刘超;牛俊峰;李阳;徐基贵;刘新华 [摘要] ( 67 ) [HTML 0 KB][PDF 651 KB] (214)
20 Synthesis, Structure and Catalytic Activity of a Palladium(II) Complex Based on 4-Chloro-2-[(6-methyl-pyridin-2-ylimino)-methyl]-phenol Ligand 2016 Vol.35(5):725-730
路学春;梁红;邓建琴;程星;陈建新;张治纯 [摘要] ( 66 ) [HTML 0 KB][PDF 415 KB] (127)
21 New Efficient Copper(II)-catalyzed Direct Access to Primary Amide from Aldehyde under Solvothermal Condition and Related Crystal Structure Study 2016 Vol.35(5):796-804
陈鸿;刘明国 [摘要] ( 66 ) [HTML 0 KB][PDF 730 KB] (144)
22 Synthesis, Crystal Structure and Antimicrobial Activity of {[Bis(pyridine-N)bis(3,5-dinitrosalicylato -O,Oˊ)Zn(II)][bis(pyridine-N)Zn(II)]} 2016 Vol.35(5):705-712
CHANG Fouzia;MEMON Najma;AHMED Muhammad Naeem;TAHIR Muhammad Nawaz;MEMON Shahabu [摘要] ( 66 ) [HTML 0 KB][PDF 847 KB] (168)
23 A Novel Chiral Cd-organic Network Based on Flexible Coupled Cinnamic Acid 2016 Vol.35(5):805-810
陈新;张明星;黄坤林 [摘要] ( 65 ) [HTML 0 KB][PDF 507 KB] (121)
24 A New Europium Coordination Compound Supported by 4,6-Dibenzoylisophthalic Acid Ligands 2016 Vol.35(5):758-764
朱晓飞;谢晓燕;毕研峰;杨玉;周德凤 [摘要] ( 65 ) [HTML 0 KB][PDF 963 KB] (157)
25 Synthesis, Crystal Structure and Fluorescence of Bicyclic Product Containing Chromene and Propargylamine Skeleton 2016 Vol.35(8):1277-1282
庞韬;王慧;吴雪;武琳;赵智勇;吴根华 [摘要] ( 63 ) [HTML 0 KB][PDF 557 KB] (136)
26 The First Principle Study on C-doped Armchair Boron Nitride Nanoribbon Rectifier 2016 Vol.35(10):1483-1490
杨娥;林祥栋;林正欢;凌启淡 [摘要] ( 63 ) [HTML 0 KB][PDF 872 KB] (259)
27 Syntheses, Structures and Anticancer Activities of Three 4(3H)-Quinazolinone Cd(II) Complexes 2016 Vol.35(6):863-871
李石雄;廖蓓玲;银秀菊;张金恒;蒋毅民 [摘要] ( 62 ) [HTML 0 KB][PDF 1010 KB] (187)
28 One New 3D Pillared-layer Ag(I)-Coordination Framework Based on a Unique 1D Ag2O2 Ribbon: Synthesis, Crystal Structure and Luminescent Properties 2016 Vol.35(8):1238-1244
王建芳;吴亚盘;伍学谦;文国选;王超 [摘要] ( 62 ) [HTML 0 KB][PDF 1580 KB] (112)
29 Synthesis, Structural Characterization and Catalytic Activity of Copper(I) Complexes with Triphenylphosphine and Pyridine Derivatives 2016 Vol.35(5):740-746
刘桂艳;徐颖;刘成鑫 [摘要] ( 61 ) [HTML 0 KB][PDF 480 KB] (157)
30 Catalytic Hydrogenation of Nitrobenzene to Aniline by Ag/γ-Fe2O3 2016 Vol.35(6):872-878
赵玲玲;王海峰;祁刚; [摘要] ( 60 ) [HTML 0 KB][PDF 648 KB] (193)
结构化学
月刊(1982年创刊)
主管单位:中国科学院
主办单位:中国化学会
      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)
协办单位:南开大学
 福州大学
主  编:吴新涛
编辑出版单位:《结构化学》编委会、编辑部
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