Spectroscopic and Computational Studies of Supramolecular Systems

Spectroscopic and Computational Studies of Supramolecular Systems PDF Author: J.E. Davies
Publisher: Springer Science & Business Media
ISBN: 940157989X
Category : Science
Languages : en
Pages : 310

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Book Description
Physical techniques such as X-ray crystallography, IR spectroscopy and solution-phase NMR spectroscopy have played key roles in the development of supramolecular chemistry. In recent years other spectroscopic techniques have been applied, expanding the range of information obtainable. The most widely used technique is solid-state NMR spectroscopy but techniques such as neutron scattering and NQR spectroscopy can yield significant information. Computational approaches are now becoming powerful complementary methods to experimental techniques and this book reviews the application of these methods to supramolecular systems. The ten chapters provide up-to-date information on the applications of spectroscopic and computational techniques to a wide range of supramolecular systems: Solid State NMR Studies of Host-Guest Materials Infrared Studies of Zeolite Complexes NQR Studies of Inclusion Compounds Neutron Scattering Studies of Zeolite Complexes Solid State NMR Studies of Catalytic Reactions on Molecular Sieves Recent Advances in Computational Studies of Zeolites Theoretical Studies of Cyclodextrins and their Inclusion Complexes Computer Modelling of the Structures of Host-Guest Complexes Computational Studies of Clathrate Hydrates Ab initio Electronic Structure Calculations on Endohedral Complexes of the C60 Cluster. This timely book will prove to be of great value to supramolecular researchers who are familiar with the spectroscopic techniques but who wish to extend their knowledge of the computational methods (and vice versa), to supramolecular researchers working in allied areas whose work would benefit from applying spectroscopic and computational methods, and finally to workers just entering the fascinating area of supramolecular chemistry.

Spectroscopic and Computational Studies of Supramolecular Systems

Spectroscopic and Computational Studies of Supramolecular Systems PDF Author: J.E. Davies
Publisher: Springer Science & Business Media
ISBN: 940157989X
Category : Science
Languages : en
Pages : 310

Get Book Here

Book Description
Physical techniques such as X-ray crystallography, IR spectroscopy and solution-phase NMR spectroscopy have played key roles in the development of supramolecular chemistry. In recent years other spectroscopic techniques have been applied, expanding the range of information obtainable. The most widely used technique is solid-state NMR spectroscopy but techniques such as neutron scattering and NQR spectroscopy can yield significant information. Computational approaches are now becoming powerful complementary methods to experimental techniques and this book reviews the application of these methods to supramolecular systems. The ten chapters provide up-to-date information on the applications of spectroscopic and computational techniques to a wide range of supramolecular systems: Solid State NMR Studies of Host-Guest Materials Infrared Studies of Zeolite Complexes NQR Studies of Inclusion Compounds Neutron Scattering Studies of Zeolite Complexes Solid State NMR Studies of Catalytic Reactions on Molecular Sieves Recent Advances in Computational Studies of Zeolites Theoretical Studies of Cyclodextrins and their Inclusion Complexes Computer Modelling of the Structures of Host-Guest Complexes Computational Studies of Clathrate Hydrates Ab initio Electronic Structure Calculations on Endohedral Complexes of the C60 Cluster. This timely book will prove to be of great value to supramolecular researchers who are familiar with the spectroscopic techniques but who wish to extend their knowledge of the computational methods (and vice versa), to supramolecular researchers working in allied areas whose work would benefit from applying spectroscopic and computational methods, and finally to workers just entering the fascinating area of supramolecular chemistry.

Spectroscopic and Computational Studies of Supramolecular Systems

Spectroscopic and Computational Studies of Supramolecular Systems PDF Author: J. E. Davies
Publisher:
ISBN: 9789401579902
Category :
Languages : en
Pages : 320

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Book Description


Host–Guest Chemistry

Host–Guest Chemistry PDF Author: Brian D. Wagner
Publisher: Walter de Gruyter GmbH & Co KG
ISBN: 3110564386
Category : Science
Languages : en
Pages : 288

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Book Description
This textbook addresses the chemical and physicochemical principles of supramolecular host-guest chemistry in solution. It covers the thermodynamics and dynamics of inclusion and highlights several types of organic hosts. Various applications of host-guest chemistry in analytical and environmental chemistry as well as pharmaceutical and chemical industry demonstrate the versatile usability of molecular cages.

Proceedings of the Symposium on Recent Advances in the Chemistry and Physics of Fullerenes and Related Materials

Proceedings of the Symposium on Recent Advances in the Chemistry and Physics of Fullerenes and Related Materials PDF Author: Karl M. Kadish
Publisher: The Electrochemical Society
ISBN: 9781566770828
Category : Science
Languages : en
Pages : 1784

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Book Description


Characterization I

Characterization I PDF Author: Hellmut G. Karge
Publisher: Springer Science & Business Media
ISBN: 9783540643357
Category : Science
Languages : en
Pages : 636

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Book Description
Molecular Sieves - Science and Technology covers, in a comprehensive manner, the science and technology of zeolites and all related microporous and mesoporous materials. Authored by renowned experts, the contributions are grouped together topically in such a way that each volume of the book series deals with a specific sub-field. Volume 4 covers the characterization of molecular sieves with the help of the most important spectroscopic techniques (Characterization I), i.e. IR, Raman, NMR, EPR, UV-VIS Spectroscopy, X-ray absorption, photoelectron and Mössbauer Spectroscopy. Theory, experiment and application in selected examples are discussed.

Clathrate Hydrates, 2 Volumes

Clathrate Hydrates, 2 Volumes PDF Author: John A. Ripmeester
Publisher: John Wiley & Sons
ISBN: 3527339841
Category : Technology & Engineering
Languages : en
Pages : 835

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Book Description
Clathrate Hydrates All-inclusive reference on clathrate hydrates from a molecular perspective Clathrate hydrates are crystalline water-based inclusion compounds many of which form at high pressures and low temperatures. Molecular science has provided the foundation for many areas of modern hydrate research and applications ranging from desalination processes to flow assurance in oil and gas pipelines. Clathrate Hydrates provides detailed information on the molecular science aspects of hydrate research, covering the structural, compositional, spectroscopic, thermodynamic, and mechanical properties of clathrate hydrates as well as simulation methods and selected engineering applications. Edited and authored by recognized leaders in the field, this comprehensive resource introduces readers to clathrate hydrates and reviews the state-of-the-art of the field. In-depth chapters address different areas of specialization such as characterization of clathrate hydrates using NMR spectroscopy, infrared and Raman spectroscopy, and X-ray and neutron diffraction and scattering. Highlights recent developments in clathrate hydrate research and applications such as natural gas recovery, desalination, and gas separation Reviews various molecular simulation methods for characterizing clathrate hydrates, including quantum mechanical calculations and Monte Carlo results Contains tables of known guest molecules, summaries of structural and physical properties, and different classes of clathrate hydrate phase equilibria Introduces unconventional guest-host interactions, related non-hydrate clathrates, and space-filling cages using the Frank-Kasper approach Covers the molecular motion of guest and host molecules and the relationship between cage geometry and guest dynamics Presents the rate and mechanisms of hydrate formation and decomposition from both macroscopic and microscopic points Clathrate Hydrates: Molecular Science and Characterization is an indispensable reference for materials scientists, physical chemists, chemical engineers, geochemists, and graduate students in relevant areas of science and engineering.

Spectroscopic Properties of Inorganic and Organometallic Compounds

Spectroscopic Properties of Inorganic and Organometallic Compounds PDF Author: G Davidson
Publisher: Royal Society of Chemistry
ISBN: 184755511X
Category : Science
Languages : en
Pages : 476

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Book Description
Spectroscopic Properties of Inorganic and Organometallic Compounds provides a unique source of information on an important area of chemistry. Divided into sections mainly according to the particular spectroscopic technique used, coverage in each volume includes: NMR (with reference to stereochemistry, dynamic systems, paramagnetic complexes, solid state NMR and Groups 13-18); nuclear quadrupole resonance spectroscopy; vibrational spectroscopy of main group and transition element compounds and coordinated ligands; and electron diffraction. Reflecting the growing volume of published work in this field, researchers will find this Specialist Periodical Report an invaluable source of information on current methods and applications. Specialist Periodical Reports provide systematic and detailed review coverage in major areas of chemical research. Compiled by teams of leading experts in their specialist fields, this series is designed to help the chemistry community keep current with the latest developments in their field. Each volume in the series is published either annually or biennially and is a superb reference point for researchers. www.rsc.org/spr

Superhalogens and Superalkalis

Superhalogens and Superalkalis PDF Author: Pratim Kumar Chattaraj
Publisher: CRC Press
ISBN: 1003838464
Category : Science
Languages : en
Pages : 287

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Book Description
Superhalogens and Superalkalis is a comprehensive volume designed as the go-to resource on the exciting and evolving topics of these special classes of atomic clusters and the acid salt that results from their interactions. The book details how these substances possess not only unusual structures but also unique properties which can be exploited for various applications. Superhalogens’ strong oxidizing capacity, resulting from their high-electron affinity, leads to their applications in the design of superacids, organic superconductors, and ionic liquids. The low ionization energy of superalkalis enables them to act as strong reducing agents, making them useful in the design of superbases and alkalides. Illustrated throughout, this timely book provides an overview of the research and development on these and other aspects of superhalogen and superalkalis. Key features: Offers a basic introduction of superatoms that is accessible for readers to understand. Includes extensive study questions after each chapter. Provides a systematic presentation of the existing literature on this increasingly trending topic. Presents the latest developments in the field, offering readers state-of-art knowledge. This book is a key reference guide for graduate students, postdocs, upper-level undergraduate students, academic professionals, and researchers who are interested in this fascinating topic.

Progress in Inorganic Chemistry, Volume 45

Progress in Inorganic Chemistry, Volume 45 PDF Author: Kenneth D. Karlin
Publisher: John Wiley & Sons
ISBN: 0470167033
Category : Science
Languages : en
Pages : 522

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Book Description
Innovation today . . . Practice tomorrow. PROGRESS in Inorganic Chemistry Today's cutting-edge chemical experimentation is a foretaste of thetechnical arsenal of tomorrow's chemist. Progress in InorganicChemistry affords instant and convenient access to every area ofinnovative chemical research and has long served as theprofessional chemist's index to the newest and influential turns ininorganic chemistry. Featuring the work of internationally renownedchemists, Volume 45 discusses: * Selective Recognition of Organic Molecules by Metallohosts (JamesW. Canary and Bruce C. Gibb, New York University) * Metallacrowns: A New Class of Molecular Recognition Agents(Vincent L. Pecoraro, Ann J. Stemmler, Brian R. Gibney, Jeffrey J.Bodwin, Hsin Wang, Jeff W. Kampf, and Almut Barwinski, Universityof Michigan) * The Interpretation of Ligand Field Parameters (Adam J. Bridgemanand Malcolm Gerloch, University Chemical Laboratories) * Chemistry of Transition Metal Cyanide Compounds: ModernPerspectives (Kim R. Dunbar and Robert A. Heintz, Michigan StateUniversity) * Assembling Sugars and Metals: Novel Architectures andReactivities in Transition Metal Chemistry (Umberto Piarulli andCarlo Floriani, University of Lausanne) * Oxygen Activation Mechanism at the Binuclear Site of Heme-CopperOxidase Superfamily as Revealed by Time-Resolved Resonance RamanSpectroscopy (Teizo Kitagawa and Takashi Ogura, Institute forMolecular Science) "This series is distinguished not only by its scope and breadth,but also by the depth and quality of the reviews." --Journal of theAmerican Chemical Society "This series is a valuable addition to the library of thepracticing research chemist, and is a good starting point forstudents wishing to understand modern inorganic chemistry."--Canadian Chemical News "[This series] has won a deservedly honored place on the bookshelfof the chemist attempting to keep afloat in the torrent of originalpapers on inorganic chemistry." --Chemistry in Britain

Handbook of Zeolite Science and Technology

Handbook of Zeolite Science and Technology PDF Author: Scott M. Auerbach
Publisher: CRC Press
ISBN: 0824756126
Category : Technology & Engineering
Languages : en
Pages : 1526

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Book Description
The Handbook of Zeolite Science and Technology offers effective analyses ofsalient cases selected expressly for their relevance to current and prospective research. Presenting the principal theoretical and experimental underpinnings of zeolites, this international effort is at once complete and forward-looking, combining fundamental concepts with the most sophisticated data for each scientific subtopic and budding technology. Supplying over 750 figures, and 350 display equations, this impressive achievement in zeolite science observes synthesis through the lens of MFI (ZSM-5 and silicalite). Chapters progress from conceptual building blocks to complex research presentations.