Results 181 to 190 of about 2,440 (209)
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On the atomic polar tensor (APT) approach for vibrational circular dichroism (VCD) and Raman optical activity (ROA)

Molecular Physics, 1988
From matrix formalisms for VCD and ROA inspired by the polar tensor infrared intensity theory, and by the polar tensor and the Mayants-Averbukh Raman intensity theories, it is found that the APT approach of Freedman and Nafie can be extended by appropriate transformations of the occurring origin dependent atomic axial tensors (AATs).
openaire   +1 more source

Optically Active Trialkynyl(phenyl)methane: Synthesis and Determination of Its Absolute Configuration by Vibrational Circular Dichroism (VCD) and Optical Rotatory Dispersion (ORD)

European Journal of Organic Chemistry, 2010
AbstractBoth enantiomers of an optically active trialkynyl(phenyl)methane (the key building blocks in the construction of a stable expanded cubane) have been prepared. The strategy involved the resolution of a racemic intermediate by means of HPLC on a chiral stationary phase.
Boris Buschhaus   +5 more
openaire   +1 more source

Preparation of cruciferous phytoalexin related metabolites, (−)-dioxibrassinin and (−)-3-cyanomethyl-3-hydroxyoxindole, and determination of their absolute configurations by vibrational circular dichroism (VCD)

Tetrahedron Letters, 2003
Abstract Cruciferous phytoalexin related metabolites, (−)-dioxibrassinin ( 1 ) and (−)-3-cyanomethyl-3-hydroxyoxindole ( 2 ) were prepared from isatin as racemates and were resolved by chiral HPLC. Their absolute configurations were determined by the new chiroptical technique, vibrational circular dichroism (VCD), as well as by the conventional ...
Kenji Monde   +6 more
openaire   +1 more source

Attenuated total reflection infrared (ATR-IR) spectroscopy, modulation excitation spectroscopy (MES), and vibrational circular dichroism (VCD)

2011
This chapter describes the potential and limitations of attenuated total reflection infrared (ATR-IR) spectroscopy, modulation excitation spectroscopy (MES), and vibrational circular dichroism (VCD) for the investigation of bio-interfaces. The three techniques are completely independent of each other although ATR-IR and MES can be combined.
openaire   +2 more sources

FT-Vibrational Circular Dichroism (VCD) Spectra and ab initio 6-31G*(0.3) Intensities for Camphor and 2-Vinyl-exo-borneol

1997
The FT-IR absorption and FT-IR VCD spectra in the region 1600−800 cm−1 are reported for 2-vinyl-exo-borneol and compared to those of camphor. Optimized geometries, harmonic force fields, and absorption spectra were calculated by ab initio means at the 6−31G*(03) level of RHF/SCF for both molecules.
Dimiter Tsankov   +2 more
openaire   +1 more source

Bioplastics for a circular economy

Nature Reviews Materials, 2022
Jan-Georg Rosenboom   +2 more
exaly  

New frontiers in enzyme immobilisation: robust biocatalysts for a circular bio-based economy

Chemical Society Reviews, 2021
Roger Arthur Sheldon, Dean Brady
exaly  

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