ChemInform Abstract: Recent Advances in Stereodynamics and Conformational Analysis by Dynamic NMR and Theoretical Calculations

ChemInform ◽  
2010 ◽  
Vol 41 (29) ◽  
pp. no-no
Author(s):  
Daniele Casarini ◽  
Lodovico Lunazzi ◽  
Andrea Mazzanti
Keyword(s):  
Conformational Analysis ◽  
Theoretical Calculations ◽  
Dynamic Nmr ◽  
Recent Advances

Conformational analysis of 2-halocyclopentanones by NMR and IR spectroscopies and theoretical calculations

2009 ◽  
Vol 72 (5) ◽  
pp. 1089-1096 ◽  
Author(s):  
Carina R. Martins ◽  
Lucas C. Ducati ◽  
Cláudio F. Tormena ◽  
Roberto Rittner
Keyword(s):  
Conformational Analysis ◽  
Theoretical Calculations

ChemInform Abstract: The Conformational Analysis of Organic Molecules by Theoretical Calculations.

ChemInform ◽  
2010 ◽  
Vol 33 (10) ◽  
pp. no-no
Author(s):  
Jun Kawakami ◽  
Yasushi Kawakami ◽  
Ryo Miyamoto ◽  
Kazuo Nakamura ◽  
Hisako Kojima ◽  
...  
Keyword(s):  
Conformational Analysis ◽  
Organic Molecules ◽  
Theoretical Calculations

scholarly journals Silacyclohexanes, Sila(hetero)cyclohexanes and Related Compounds: Structure and Conformational Analysis

Molecules ◽  
2020 ◽  
Vol 25 (7) ◽  
pp. 1624 ◽  
Author(s):  
Bagrat A. Shainyan
Keyword(s):  
Nmr Spectroscopy ◽  
Electron Diffraction ◽  
Low Temperature ◽  
Conformational Analysis ◽  
Gas Phase ◽  
Theoretical Calculations ◽  
Gas Electron Diffraction ◽  
Experimental Measurements ◽  
Related Compounds

Conformational analysis of Si-mono- and Si,Si-disubstituted silacyclohexanes as well as their analogues with a heteroatom(s) in the ring is reviewed with the focus on the recent results. Experimental measurements in the gas phase (gas electron diffraction, GED) and low temperature NMR spectroscopy (LT NMR) on 1H, 13C and 29Si nuclei are described along with theoretical calculations at the DFT and MP2 levels of theory. Structural and conformational specific features are shown to be principally different from those of the carbon predecessors—the corresponding cyclohexanes, oxanes, thianes and piperidines. The role of various effects (steric, hyperconjugation, stereoelectronic, electrostatic) is demonstrated.

1-t-Butyl-1-phenyl-1-silacyclohexane: Synthesis, conformational analysis in gas and solution by GED, FT-IR and theoretical calculations

2020 ◽  
Vol 923 ◽  
pp. 121433 ◽  
Author(s):  
Bagrat A. Shainyan ◽  
Elena N. Suslova ◽  
Tran Dinh Phien ◽  
Sergey A. Shlykov ◽  
Larisa P. Oznobikhina
Keyword(s):  
Conformational Analysis ◽  
Theoretical Calculations ◽  
Ft Ir
Sign in / Sign up

Export Citation Format

Share Document