scholarly journals Simulation of Vacuum UV Absorption and Electronic Circular Dichroism Spectra of Methyl Oxirane: The Role of Vibrational Effects

2016 ◽  
Vol 12 (6) ◽  
pp. 2820-2833 ◽  
Author(s):  
Manuel Hodecker ◽  
Malgorzata Biczysko ◽  
Andreas Dreuw ◽  
Vincenzo Barone
Keyword(s):  
Circular Dichroism ◽  
Uv Absorption ◽  
Circular Dichroism Spectra ◽  
Electronic Circular Dichroism ◽  
Circular Dichroïsm ◽  
Vacuum Uv

scholarly journals Chiroptical characterization tools for asymmetric small molecules – experimental and computational approaches for electronic circular dichroism (ECD) and anisotropy spectroscopy

RSC Advances ◽  
2021 ◽  
Vol 11 (3) ◽  
pp. 1635-1643
Author(s):  
Amanda C. Evans ◽  
Andrew S. Petit ◽  
Steven G. Guillen ◽  
Amanda J. Neukirch ◽  
Søren V. Hoffmann ◽  
...  
Keyword(s):  
Circular Dichroism ◽  
Small Molecules ◽  
Mandelic Acid ◽  
Circular Dichroism Spectra ◽  
Electronic Circular Dichroism ◽  
Computational Approaches ◽  
Anisotropy Spectra ◽  
Circular Dichroïsm ◽  
Vacuum Uv

Experimental and computational electronic circular dichroism spectra are used in conjunction with anisotropy spectra to chiroptically characterize mandelic acid and its derivatives into the vacuum UV.

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