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内部出版物
在“
Elsevier电子期刊
”中,
命中:
4
条,耗时:小于0.01 秒
1.
One-pot synthesis, FT-IR and density functional method (DFT) studies on N-benzyl-N-ethyl-N-[5-nitro-2-(1,1,3,3-Tetramethylbutylamino)-1-benzofuran-3-yl]amine
作者:
Esmail
Vessally
;
Ehsan Fereyduni
;
Hana Shabrendi
;
Mehdi D. Esrafili
关键词:
N-benzyl-N-ethyl-N-[5-nitro-2-(1
13 ;
3-Tetramethylbutylamino))-1-benzofuran-3-yl]amine
;
Vibrational spectrum
;
Ugi reaction
;
FT-IR
;
DFT
刊名:Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy
出版年:2013
2.
HRgCN and HRgNC as halogen bond acceptors (Rg = Kr and Xe): A theoretical study upon strength and nature of halogen?nitrogen and halogen?carbon interactions
作者:
Mehdi D. Esrafili
;
Saleh Shahabiv
;
Esmail
Vessally
关键词:
Halogen bond
;
¦Ò-Holes
;
Energy decomposition
;
DFT
;
Electrostatic interaction
刊名:Computational and Theoretical Chemistry
出版年:2013
3.
The location of stationary points in the reaction of fluoroformyloxyl radical (FCO
2
(C
2V
)) with atomic hydrogen: A computational study on the pathways of the singlet and triplet reaction and intersystem crossing
作者:
Esmail
Vessally
;
Sattar Ebrahimi
;
Moein Goodarzi
;
Abdolvahab Seif
关键词:
Fluoroformyloxyl
;
Mechanism
;
PES
;
MECP
刊名:Computational and Theoretical Chemistry
出版年:2013
4.
A study of the interaction energy between a glycoluril molecular clip and dihydroxybenzenes or diaminobenzenes: a justification for easy separation by affinity chromatography
作者:
Esmail
Vessally
;
Fahimeh Hokmabadi
关键词:
Glycoluril
;
Molecular clip
;
Dihydroxybenzenes
;
Diaminobenzenes
刊名:Tetrahedron Letters
出版年:2012
1
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