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VCD spectroscopy for organic chemists

Autor: Philip J Stephens; Frank J Devlin; James R Cheeseman
Editora: Boca Raton : CRC Press, ©2012.
Edição/Formato   Livro : InglêsVer todas as edições e formatos
Base de Dados:WorldCat
Resumo:
"The purpose of this book is to increase the awareness of organic chemists of the utility of VCD spectroscopy. To this end, successive chapters present experimental measurement of VCD spectra and their analysis; experimental measurement of vibrational absorption and VCD spectra; fundamental quantum-mechanical theory of the vibrational states of molecules and of their vibrational absorption and VCD spectra;  Ler mais...
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Tipo de Documento: Livro
Todos os Autores / Contribuintes: Philip J Stephens; Frank J Devlin; James R Cheeseman
ISBN: 9781439821718 1439821712
Número OCLC: 775590824
Descrição: x, 360 p. : ill. (some col.) ; 25 cm.
Conteúdos: Introduction to Vibrational Circular Dichroism The Experimental Measurement of Vibrational Absorption and Vibrational Circular Dichroism Spectra Vibrational Absorption Measurement VCD Measurement IR Absorption and VCD Spectra of Specific Molecules Camphor alpha-Pinene The Theory of IR and VCD Spectra Ab Initio Methods Molecular Orbital Theory Application of Analytical Derivative DFT Techniques to the Calculation of Forces, Hessian, APTs, and AATs Origin Dependence of the AATs Classification of Basis Sets Functionals for DFT Computational Procedures Integration Grids IR and VCD Spectra Calculation Conformational Analysis Analyses of the IR and VCD Spectra of Conformationally Rigid Molecules Camphor alpha-Pinene Methyloxirane Determination of Absolute Configuration Applications of VCD Spectroscopy to Organic Chemistry Troger's Base 2-(1-Hydroxyethyl)-Chromen-4-One and Its 6-Br Derivative The Supramolecular Tetramer of 2,2'-Dimethyl-Biphenyl-6,6'-Dicarboxylic Acid Trans-Para-Methyl-Phenyl-Glycidic Acid The Cytotoxic Sesquiterpene Natural Product, Quadrone A Chiral Oxadiazol-3-One Calcium Channel Blocker The Alkaloid Natural Product, Schizozygine The Iridoid Natural Product, Plumericin The Chiral Alkane, D3-Anti-Trans-Anti-Trans-Anti-Trans-Perhydrotriphenylene The Isotopically Chiral Sulfoxide, Perdeuteriophenyl-Phenyl-Sulfoxide The Sex Pheromone of the Obscure Mealybug A Thia-Bridged Triarylamine Heterohelicene Enone Precursor to Nor-Suberosenone and Nor-Suberosanone
Responsabilidade: Philip J. Stephens, Frank J. Devlin, James R. Cheeseman.
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Resumo:

Chiral drugs are a major focus of pharmaceutical companies. This book presents the technique of Vibrational Circular Dichroism (VCD) spectroscopy and discusses its applications to the structural  Ler mais...

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"An extremely well-written book that achieves the authors' goal of being a comprehensive textbook. ... I highly recommend [the book] as the textbook of choice on this useful topic." -Chemistry World, Ler mais...

 
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