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Titlebook: Recent Experimental and Computational Advances in Molecular Spectroscopy; R. Fausto Book 1993 Springer Science+Business Media Dordrecht 19

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Molecular Structure from Rotational and Vibrational Transitions in Electronic Spectra,onding electronic state. The results of various techniques, from rotational band contour analysis of room temperature absorption spectra to line-by-line analysis of very high resolution supersonic jet fluorescence excitation or multiphoton Ionisation spectra, are discussed, as applied to the So and
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From Qualitative to Quantitative Analyses of Circular Dichroism Spectra Using the Convex Constraintt. The optical activity of dissimetric crystals was first observed almost two hundred years ago (Arago, 1811). However, the application of optical rotatory dispersion (ORD) and circular dichroism (CD) to study peptide and protein conformations started only in the last three decades. This was followe
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Computer-Aided Methods for the Resolution Enhancement of Spectral Data with Special Emphasis on Inf000. There are mathematical procedures that can make use of this high signal-to-noise ratio to calculate spectroscopic parameters of prime importance to the spectroscopist: the positions and intensities of individual absorption bands. In this manuscript we describe, in theory and practice, two such
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,α,ß-Unsaturated Carboxylic Esters and Their Hydrogen Bond Complexes with Substituted Phenols: Vibra— and the extent of hydrogen bonding between the carbonyl group of these ester compounds and some phenol derivatives in carbon tetrachloride solutions, are herein considered and studied. A linear relationship between △vC=0 due to the hydrogen bond and the enthalpy of complex formation is found, prov
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Experimental and Ab Initio Quantum Mechanical Studies of the Vibrational Spectra of Isolated Pyrimihniques for study of the vibrational spectra of matrix-isolated pyrimidines are described, and the reasons for such studies are illustrated by comparison of the infrared and Raman spectra of matrix-isolated thymine with spectra in the solid phase. Comparison of the infrared spectrum of p-quinone iso
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