HYDROGEN_BONDING

作品数:261被引量:243H指数:6
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相关作者:吴志坚卿彬菊叶秀深李喆熊肖更多>>
相关机构:华东理工大学中国科学院中国科学院研究生院华侨大学更多>>
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Smart crystalline frameworks constructed with bisquinoxaline-based component for multi-stimulus luminescent sensing materials被引量:1
《Chinese Journal of Structural Chemistry》2023年第2期9-22,共14页Peng-Da Liu Ao-Gang Liu Peng-Min Wang Yuan Chen Bao Li 
the National Natural Science Foundation of China(No.92161123,21971078);the Frontier Project of Application Foundation of Wuhan Science and Technology Bureau of China(No.2020010601012201).
Crystalline materials with well-defined structures and ordered molecular arrays can provide a new research platform to fabricate new smart materials with excellent stimulus response properties.Among them,Luminescent M...
关键词:Metal-organic framework Hydrogen bonding organic framework Luminescent sening Bisquinoxaline group Sensor 
Pendant Group Effect of Polymeric Dielectrics on the Performance of Organic Thin Film Transistors
《Chinese Journal of Structural Chemistry》2021年第11期1541-1549,1410,共10页HUANG Chong-Yu FENG Shi-Yu HUANG Wei-Guo 
supported by the start-up funding from FJIRSM-CAS;National Natural Science foundation of China(51803214)。
Polymer dielectric is superior to its inorganic counterparts due to not only the low cost and intrinsic flexibility,but also the readily tunable dielectric constant,surface charge trap density,charge ejection and rele...
关键词:polymer dielectric organic thin film transistor hydrogen bonding π-electron delocalization noncovalent interaction 
Quantum Chemical Studies of Host-guest Nanostructures of PAMAM Dendrimers in Drug Deliver
《Chinese Journal of Structural Chemistry》2020年第5期838-848,共11页HAGHIGHI Fatemeh MORSALI Ali BOZORGMEHR Mohammad Reza BEYRAMABADI SAli 
Using B3LYP and M06-2X functionals,eight noncovalent configurations for the adsorption of D-penicillamine drug(DPA)drug on poly(amidoamine)G0 generation dendrimer(PAMAMG0)carrier have been investigated.The quantum mol...
关键词:DFT D-PENICILLAMINE hydrogen bonding NANOMEDICINE poly(amidoamine)dendrimer 
Theoretical Study of Pnicogen Bonding Interactions between ECl3(P, As) and Different Electron Donors
《Chinese Journal of Structural Chemistry》2019年第12期2027-2040,共14页XU Hui-Ying WANG Wei ZHU Jian-Qing ZOU Jian-Wei XU Xiao-Lu LU Yin 
supported by the Public Technology Research Project(Analysis and Measurement)of Zhejiang Province(LGC19B070004);State Key Laboratory of Environmental Chemistry and Ecotoxicology,Research Center for Eco-environmental Sciences,Chinese Academy of Sciences(KF2018-15);Program for the Philosophy and Social Research in Zhejiang Province(19NDJC262YB)
The pnicogen bond interaction between different electron donors(anion, π-electron, heteroatom) and ECl3(E = As, P) was calculated by the method of MP2/aug-cc-p VTZ. It has been indicated that the pnicogen bonds of co...
关键词:pnicogen bonding hydrogen bonding AIM RDG analyses electronic density difference analyses 
Syntheses,Characterization and Crystal Structures of Dithiocarbamate-based Mononuclear Palladium(Ⅱ) Complexes
《Chinese Journal of Structural Chemistry》2017年第7期1185-1192,共8页李浩 蒋选丰 于澍燕 
supported by the National Natural Science Foundation of China(No.21471011);High-caliber Talents Project of Beijing Municipal Institution
By employing the dithiocarbamate salt (K(PPDC), where PPDC = 4?-pyridyl-1-pipe-razine-4-dithiocarbamate) as the functional ligand and di-palladium complexes [(N^N)2Pd2(NO3ˉ)2](NO3ˉ)2 (N^N = 2,2'-bipyri...
关键词:PALLADIUM DITHIOCARBAMATE coordination C-H…F hydrogen bonding 
Studies on the Conformations and Hydrogen Bonding of ACE Inhibitory Tripeptide VEF by All-atom Molecular Dynamics Simulations and Molecular Docking
《Chinese Journal of Structural Chemistry》2017年第2期189-196,共8页齐春艳 张荣 黄国栋 吴文娟 
Supported by the National Natural Science Foundation of China(No.20903026);the Talents Introduction Foundation for Universities of Guangdong Province(2011);Scientific Research Foundation of the Natural Science Foundation of Guangdong Province(No.S2011010002483)
Molecular dynamic simulations and molecular docking are performed to study the conformations and hydrogen bonding interactions of ACE inhibitory tripeptide VEF. Intramolecular distance, radius of gyration, solvent-acc...
关键词:Hydrogen bonding characterize conformation amide accessible folded bonds bonded catalyze 
Studies on the Hydrogen Bonding Network Structures of Amino-konjacglucomannan-zinc Chelate被引量:1
《Chinese Journal of Structural Chemistry》2014年第2期171-178,共8页王丽霞 姜雯 林超平 钟巧霞 庞杰 
Sponsored by National Natural Science Foundation of China(31271837);Fujian Provincial Education Department(JA11167);jointly Sponsored by the special scientific research fund for the doctor discipline point of universities by the Ministry of Education(20113515110010)
Amino-Konjacglucomannan (NH2-KGM) was prepared through the reaction of ammonium hydroxide with KGM by ultrasonic. The influence of amount of ammonium hydroxide, concentration of KGM and ultrasonic time on the extent...
关键词:Konjac glucomannan (KGM) aminated ULTRASONIC zinc sulfate CHELATE 
π-π Stacking, Hydrogen Bonding and Magnetic Coupling Mechanism on a Mono-nuclear Cu^Ⅱ Complex被引量:4
《Chinese Journal of Structural Chemistry》2012年第2期285-291,共7页李红 于丽 张士国 王玉清 石敬民 
supported by the National Natural Science Foundation of China (No. 20971080);the Natural Science Foundation of Shandong Province (No. ZR2009BM026 and ZR2009BL002)
A new mono-nuclear CuII complex [Cu(DPP)(DP)Br](ClO4)H2O (DPP = 2-(3,5- dimethyl-1H-pyrazol-1-yl)-1,10-phenanthroline, DP = 3,5-dimethyl-1H-pyrazole) has been syn- thesized with 2-(3,5-dimethyl-1H-pyrazol-1...
关键词:crystal structure magnetic coupling π-π stacking hydrogen bond copper complex 
Syntheses,Crystal Structures,and Antimicrobial Activities of 3-Bromo-N'-(2- chloro-5-nitrobenzylidene)benzohydrazide and 3-Bromo-N'-(4-nitrobenzylidene)benzohydrazide被引量:1
《Chinese Journal of Structural Chemistry》2011年第5期724-730,共7页朱海云 
supported by the Natural Science Foundation of Shaanxi Province (No. 2010JS068);the Science Research Foundation of Baoji University of Arts and Sciences (No. ZK085)
Two new hydrazone compounds, 3-bromo-N'-(2-chloro-5-nitrobenzylidene)-ben- zohydrazide 1 and 3-bromo-N'-(4-nitrobenzylidene)benzohydrazide 2, have been synthesized and characterized by elemental analysis, IR spe...
关键词:hydrazone synthesis hydrogen bonding X-ray structure analysis antimicrobial activity 
Crystal and Molecular Structure of Ethyl 2-[(4-Hydroxy-phenyl)hydrazono]-3-oxobutanoate
《Chinese Journal of Structural Chemistry》2011年第2期186-189,共4页Gnanasekaran Rajalakshmi Poomani Kumaradhas Mahesh Padaki Arun M Isloor Chitrakara Hegede Balasubramanium Sridhar 
The title compound,C 12 N 2 O 4 H 14 (M r=250.3),crystallizes in triclinic P1 space group with a=7.7709(9),b=8.7534(11),c=9.6958(12),α=77.103(2),β=80.496(2),γ=86.726(2)o,V=633.9(1) 3,Z=2,F(000)=26...
关键词:molecular structure oxobutanoate PHENYLHYDRAZONE Z-configuration hydrogen bonding 
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