Conformational analysis of tetrahydrofuran and tetrahydrothiopene using 1H NMR spectroscopy and ab initio calculations

被引：0
作者：
A. V. Chertkov
O. I. Pokrovskiy
A. K. Shestakova
V. A. Chertkov
机构：
[1] M. V. Lomonosov Moscow State University,State Research Institute of Chemistry and Technology of Organoelement Compounds
[2] Russian Federation State Science Center,undefined
来源：
Chemistry of Heterocyclic Compounds | 2008年 / 44卷
关键词：
tetrahydrothiophene; tetrahydrofuran; conformational analysis;
D O I：
暂无
中图分类号：
学科分类号：
摘要：
引用
收藏
页码：621 / 623
页数：2
相关论文
共 50 条
[31]   Conformational analysis of the endogenous μ-opioid agonist endomorphin-1 using NMR spectroscopy and molecular modeling [J].
Podlogar, BL ;
Paterlini, MG ;
Ferguson, DM ;
Leo, GC ;
Demeter, DA ;
Brown, FK ;
Reitz, AB .
FEBS LETTERS, 1998, 439 (1-2) :13-20
[32]   Conformational studies of 3-[(2,2-dimethylhydrazinyl)methylene]- pentane-2,4-dione using vibrational and NMR spectra, X-ray analysis and ab initio calculations [J].
Gatial, Anton ;
Herich, Peter ;
Tarabova, Denisa ;
Milata, Viktor ;
Pronayova, Nadezda .
JOURNAL OF MOLECULAR STRUCTURE, 2017, 1140 :163-172
[33]   Structural analysis of flavonoids in solution through DFT 1H NMR chemical shift calculations: Epigallocatechin, Kaempferol and Quercetin [J].
De Souza, Leonardo A. ;
Tavares, Wagner M. G. ;
Lopes, Ana Paula M. ;
Soeiro, Malucia M. ;
De Almeida, Wagner B. .
CHEMICAL PHYSICS LETTERS, 2017, 676 :46-52
[34]   1H and 13C NMR spectral assignments and conformational analysis of 14 19-nor-neoclerodane diterpenoids [J].
Rodríguez, B ;
Jimeno, ML .
MAGNETIC RESONANCE IN CHEMISTRY, 2004, 42 (07) :605-616
[35]   Conformational preferences of fluorocyclohexane and 1-fluoro-1-silacyclohexane molecules: ab initio study and NBO analysis [J].
Belyakov, Alexander V. ;
Baskakov, Alexander A. ;
Ivanov, Anatolii D. ;
Garabadzhiu, Alexander V. ;
Arnason, Ingvar .
STRUCTURAL CHEMISTRY, 2013, 24 (03) :763-768
[36]   Conformational preferences of fluorocyclohexane and 1-fluoro-1-silacyclohexane molecules: ab initio study and NBO analysis [J].
Alexander V. Belyakov ;
Alexander A. Baskakov ;
Anatolii D. Ivanov ;
Alexander V. Garabadzhiu ;
Ingvar Arnason .
Structural Chemistry, 2013, 24 :763-768
[37]   1H chemical shifts in NMR:: Part 22+ -: Prediction of the 1H chemical shifts of alcohols, diols and inositols in solution, a conformational and solvation investigation [J].
Abraham, RJ ;
Byrne, JJ ;
Griffiths, L ;
Koniotou, R .
MAGNETIC RESONANCE IN CHEMISTRY, 2005, 43 (08) :611-624
[38]   AB-INITIO CONFORMATIONAL-ANALYSIS OF ETHYLENE-GLYCOL AND 1,3-PROPANEDIOL [J].
BULTINCK, P ;
GOEMINNE, A ;
VANDEVONDEL, D .
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1995, 357 (1-2) :19-32
[39]   Observation of the keto tautomer of D-fructose in D2O using 1H NMR spectroscopy [J].
Barclay, Thomas ;
Ginic-Markovic, Milena ;
Johnston, Martin R. ;
Cooper, Peter ;
Petrovsky, Nikolai .
CARBOHYDRATE RESEARCH, 2012, 347 (01) :136-141
[40]   Structural study of 3-methyl-3-azabicyclo[3.2.1]octan-8α(and β)ols by ab initio calculations, NMR and IR spectroscopy [J].
Iriepa, I ;
Madrid, AI ;
Morreale, A ;
Gálvez, E ;
Bellanato, J .
JOURNAL OF MOLECULAR STRUCTURE, 2003, 651 :585-591
12345