ADDUCTS

作品数:73被引量:111H指数:5
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相关领域:理学更多>>
相关作者:韩镇辉姜岳蒋山好姚思德李医明更多>>
相关机构:中国科学院中国科学技术大学更多>>
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相关基金:国家自然科学基金安徽省自然科学基金中国博士后科学基金北京市自然科学基金更多>>
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Molecular modeling of the octacoordinated tetracarbonato-Nd(III), [Nd(CO_3)_4]^(5-), complex and its nonacoordinated fluoro- and aquo-adducts
《Journal of Rare Earths》2010年第6期847-853,共7页S. P. Sinha Alfredo M. Simas Gustavo L. C. Moura 
Theoretical investigation on the structures of the octacoordinated [Nd(CO3)4]5-and the nonacoordinated [Nd(CO3)4.OH2]5-complexes, using the SPARKLE parameters of the lanthanides within MOPAC, revealed that they posses...
关键词:LANTHANIDES theoretical molecular models octacoordination carbonato complexes ADDUCTS MOPAC SPARKLE rare earths 
Theoretical Study of Nonclassical Platinum Complexes Bonding to Purine Bases: How the Long-lived Monofunctional Adducts Can Be in Existence?
《Chinese Journal of Structural Chemistry》2006年第4期407-416,共10页常贯儒 周立新 陈动 
This work was supported by the Science Foundation of Jinan University (639)
The B3LYP/6-31G^* level of theory was used for the optimization of nonclassical platinum drugs with planar aromatic heterocycle ligands in addition to their monoaqua species, diaqua species and monofunctional adducts...
关键词:long-lived monofunctional adducts diaqua species intrastrand cross-Hnk DFT MP2 
Synthesis and characterization of adducts of p-azidostyrene derivatives to fullerene C_(60)
《Chinese Journal of Chemistry》1995年第6期525-531,共7页LI,Ji-Sheng DONG,Guo-Xiao FENG,Jun JI,Gai-JiaoInstitute of Chemistry,Chinese Academy of Sciences,Beijing 100080,China 
Fullerene C60 reacted with p-azidostyrene derivatives in refluxing chlorobenzene,yielding monoadducts 2a and 2d as well as diadduct 2c with aziridine structure at 6/6-ring junctions.Experimental results showed that t...
关键词:Pullerene azkidine regioselective adduct AZIDE 
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