Zeitschrift für Naturforschung B · 1993 · 24 citations · 1 references
Natural SciencesChemistryMedicinal ChemistryComputational ChemistryPlant BiochemistrySpectroscopyCircular Dichroism SpectroscopyMolecular SymmetrySpectroscopy Of BiomoleculesAbsolute Configuration AssignmentAbsolute Configuration DeterminationChirality DeterminationCircular DichroismCircular Dichroism AnalysisCircular Dichroism Spectroscopy AnalysisComputational Spectral SimulationStructural Elucidation From Spectra
Abstract The circular dichroism (CD) of the biaryls ancistrocladeine and dioncophylleine A has been studied. The CNDO/S method in combination with a Boltzmann weighting o f different structures using AM 1 energies has been applied to reproduce the experimental CD spectra o f the two alkaloids with known absolute configuration at with those o f the exciton chirality method.
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Lajos Moln r · Nuclear Physics · 1966 · 2.5K citations