Supported by the National Natural Science Foundation of China (Grant No. 20335030);Foundation of Education Committee of Gansu Province (Grant No. 0708-11)
The insertion and abstraction reaction mechanisms of singlet and triplet CCl2 with CH3MH (M=O, S) have been studied by using the DFT, NBO and AIM methods. The geometries of reactions, the transition state and products...
supported by the National Natural Science Foundation of China (No 20303010, 20273034 and 20673063);NKStar HPC Program The authors appreciate the assistance provided by Professor Zun-Sheng Cai
Understanding the chemistry of BNNT is a crucial step toward their ultimate practical use. A comparative study of Reactions A (ASWCNT (5,5) and CCl2) and B (ASWBNNT (5,5) and CCl2) have been performed by using...
Supported by the National Natural Science Foundation of China(Nos.20576142and50772133);the Doctor's Scientific Re-search and Innovation Foundation of Central South University of China(No.134376211).
Multiple-walled carbon nanotubes were functionalized by cycloaddition of dichlorocarbene.The chemical modification was performed by using chloroform and sodium hydroxide.Various phase transfer catalysts were used to i...
This work was supported by the National Natural Science Foundation of China (No. 20303010), NKStar HPC Program and the Science Foundation of Nankai University
The reaction mechanism between CC12 and armchair single-walled carbon nanotubes (ASWCNTs) (3,3) and (4,4) has been studied by semiempirical AM1 and ab initio methods. The activation barriers of CC12 adding to AS...
Project supported by the National Natural Science Foundation of China (No. 29575190) and the Foundation of Bioorganee and Molecular Engineering Laboratory.
The m/z of characteristic ion of the mass spectra of the dichlorocarbene of dodecen-1-ols was used as a parameter to locate the position of double bond in these isomers by a new formula.
Reaction of 2,3-dihydro-1H-l,5-benzodiazepines with dichlorocarbene generated in situ using benzyltriethylammonium chloride (TEBA) as a phase transfer catalyst in chloroform-aqueous sodium hydroxide mixture gave main...
In Me2SO, an X-philic reaction took place between α-cyanobenzyl carbanion and CCl4. The intermediate dichlorocarbene was trapped by the primary product dicyanostilbene to give the alkene-carbene adduct, 1, 1-dichloro...
The insertion of dichlorocarbene generated from chloroform by Phase Transfer Catalysis(PTC)into carbon-boron bond of dialkylborate anions 3,obtained by method A and B,resulted in the formation of the inter- mediates 5...
Three kinds of products have been separated from the reaction mixtures of 1,2-dihydro-2, 4-disubstituted-1,5-benzodiazepine with: CCI_2.Besides the addition products of: CCI_2 to C=N.the inserted products of: CCI_2 to...