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Computational Organic 2e, Bachrach SM


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Автор: Bachrach SM
Название:  Computational Organic 2e
Перевод названия: С.М. Бахрах: Вычислительная органика
ISBN: 9781118291924
Издательство: Wiley
Классификация:
ISBN-10: 1118291921
Обложка/Формат: Hardback
Страницы: 632
Вес: 1.03 кг.
Дата издания: 09.05.2014
Серия: Chemistry
Язык: English
Издание: 2nd edition
Иллюстрации: Illustrations
Размер: 243 x 158 x 38
Читательская аудитория: Professional & vocational
Ключевые слова: Chemistry
Ссылка на Издательство: Link
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Поставляется из: Англии
Описание: Building upon and updating the successful first edition, the second edition of Computational Organic Chemistry introduces computational modeling methods used as standard tools by organic chemists for searching, rationalizing, and predicting structure and reactivity of organic molecules.


Organic Chemistry, 2 ed. ISBN 9780199270293

Название: Organic Chemistry, 2 ed. ISBN 9780199270293
ISBN: 0199270295 ISBN-13(EAN): 9780199270293
Издательство: Oxford Academ
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Цена: 11562.00 р.
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Описание: Inspiring and motivating students from the moment it published, Organic Chemistry has established itself in just one edition as the students` choice of organic chemistry text. Its explanatory, mechanistic, evidence-based approach makes it perfect for fostering a true understanding of the subject.

Advanced Organic Chemistry Part B: Reaction and Synthesis

Название: Advanced Organic Chemistry Part B: Reaction and Synthesis
ISBN: 0387683542 ISBN-13(EAN): 9780387683546
Издательство: Springer
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Цена: 8384.00 р.
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Описание: The two-part, fifth edition of Advanced Organic Chemistry has been substantially revised and reorganized for greater clarity. together, with Part A: Structure and Mechanisms, the two volumes provide a comprehensive foundation for the study in organic chemistry.

Solutions Manual to accompany Organic Chemistry

Автор: Clayden
Название: Solutions Manual to accompany Organic Chemistry
ISBN: 0199663343 ISBN-13(EAN): 9780199663347
Издательство: Oxford Academ
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Цена: 9027.00 р.
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Описание: The solutions manual to accompany Organic Chemistry provides fully-explained solutions to problems that accompany each chapter of the second edition of the book.

Mechanisms of Organic Reactions

Автор: Maskill, Howard (Senior Lecturer, University of Ne
Название: Mechanisms of Organic Reactions
ISBN: 0198558228 ISBN-13(EAN): 9780198558224
Издательство: Oxford Academ
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Цена: 5226.00 р.
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Описание: The book begins with the modern concepts of organic chemical reactivity, then presents a concise up to date account of the mechanisms of major reactions of simple organic compounds. Each chapter leads the student from the experimental evidence to the mechanistic deductions, and ends with problems for students to work through, and a short bibliography.

Organic Syntheses Based on Name Reactions,

Автор: A. Hassner
Название: Organic Syntheses Based on Name Reactions,
ISBN: 0080966306 ISBN-13(EAN): 9780080966304
Издательство: Elsevier Science
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Цена: 9264.00 р.
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Описание: Organic Syntheses Based on Named Reactions is an indispensable reference companion for chemistry students and researchers. Building on Hassner & Stumer’s highly regarded 2e, this new work reviews 750 reactions, with over 100 new stereoselective and regioselective reactions. Each A-Z entry provides a carefully condensed summary of valuable information that a chemist needs to understand and utilize these fundamental reactions in their work, including brief practical details. The book is illustrated with real synthetic examples from the literature and about 3,400 references to the primary literature to aid further reading. Extensive indexes (name, reagent, reaction) and a very useful functional group transformation index help the reader fully navigate this extensive collection of important reactions. With its comprehensive coverage, superb organization and quality of presentation, this long-awaited new edition belongs on the shelf of every organic chemist.

Computational Mechanisms of Au and Pt Catalyzed Reactions

Автор: Soriano
Название: Computational Mechanisms of Au and Pt Catalyzed Reactions
ISBN: 3642210821 ISBN-13(EAN): 9783642210822
Издательство: Springer
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Цена: 45712.00 р.
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Описание: Structure, Bonding, and Reactivity of Reactant Complexes and Key Intermediates, by Elena Soriano and Jos? Marco-Contelles.-Cycloisomerization of 1,n-Enynes Via Carbophilic Activation, by Patrick Yves Toullec and V?ronique Michelet.- DFT-Based Mechanistic Insights into Noble Metal-Catalyzed Rearrangement of Propargylic Derivatives: Chirality Transfer Processes, by Olalla Nieto Faza and Angel R. de Lera.-N-Heterocyclic Carbene Complexes of Au, Pd, and Pt as Effective Catalysts in Organic Synthesis, by Andrea Correa, Steven P. Nolan and Luigi Cavallo.-Activation of Allenes by Gold Complexes: A Theoretical Standpoint, by Max Malacria, Louis Fensterbank and Vincent Gandon.-Heterocyclization of Allenes Catalyzed by Late Transition Metals: Mechanisms and Regioselectivity, by Benito Alcaide, Pedro Almendros, Teresa Mart?nez del Campo, Elena Soriano and Jos? Marco-Contelles.-Gold-Catalyzed Cycloadditions Involving Allenes: Mechanistic Insights from Theoretical Studies, by Sergi Montserrat, Gregori Ujaque, Fernando L?pez, Jos? L. Mascare?as and Agust? Lled?s.-   

Computational Mechanisms of Au and Pt Catalyzed Reactions

Автор: Elena Soriano; Jos? Marco-Contelles
Название: Computational Mechanisms of Au and Pt Catalyzed Reactions
ISBN: 3642268854 ISBN-13(EAN): 9783642268854
Издательство: Springer
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Цена: 43100.00 р.
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Описание:

Structure, Bonding, and Reactivity of Reactant Complexes and Key Intermediates, by Elena Soriano and Jose Marco-Contelles.-

Cycloisomerization of 1, n-Enynes Via Carbophilic Activation, by Patrick Yves Toullec and Veronique Michelet.-


DFT-Based Mechanistic Insights into Noble Metal-Catalyzed Rearrangement of Propargylic Derivatives: Chirality Transfer Processes, by Olalla Nieto Faza and Angel R. de Lera.-


N-Heterocyclic Carbene Complexes of Au, Pd, and Pt as Effective Catalysts in Organic Synthesis, by Andrea Correa, Steven P. Nolan and Luigi Cavallo.-


Activation of Allenes by Gold Complexes: A Theoretical Standpoint, by Max Malacria, Louis Fensterbank and Vincent Gandon.-


Heterocyclization of Allenes Catalyzed by Late Transition Metals: Mechanisms and Regioselectivity, by Benito Alcaide, Pedro Almendros, Teresa Martinez del Campo, Elena Soriano and Jose Marco-Contelles.-


Gold-Catalyzed Cycloadditions Involving Allenes: Mechanistic Insights from Theoretical Studies, by Sergi Montserrat, Gregori Ujaque, Fernando Lopez, Jose L. Mascarenas and Agusti Lledos.-

Computational Chemistry

Автор: Lewars
Название: Computational Chemistry
ISBN: 9048138604 ISBN-13(EAN): 9789048138609
Издательство: Springer
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Цена: 22354.00 р.
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Описание: This corrected second edition contains new material which includes solvent effects, the treatment of singlet diradicals, and the fundamentals of computaional chemistry. Computational Chemistry: Introduction to the Theory and Applications of Molecular and Quantum Mechanics is an invaluable tool for teaching and researchers alike. The book provides an overview of the field, explains the basic underlying theory at a meaningful level that is not beyond beginners, and it gives numerous comparisons of different methods with one another and with experiment. The following concepts are illustrated and their possibilities and limitations are given: - potential energy surfaces; - simple and extended Hueckel methods; - ab initio, AM1 and related semiempirical methods; - density functional theory (DFT). Topics are placed in a historical context, adding interest to them and removing much of their apparently arbitrary aspect. The large number of references, to all significant topics mentioned, should make this book useful not only to undergraduates but also to graduate students and academic and industrial researchers. 

Theoretical and Computational Aspects of Magnetic Organic Mo

Автор: Datta Sambhu N
Название: Theoretical and Computational Aspects of Magnetic Organic Mo
ISBN: 1908977213 ISBN-13(EAN): 9781908977212
Издательство: World Scientific Publishing
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Цена: 16474.00 р.
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Описание: Organic materials with extraordinary magnetic properties promise a wide range of light, flexible, and inexpensive alternatives to familiar metal-based magnets. Individual organic molecules with high magnetic moments will be the foundation for design and fabrication of these materials.This book provides a systematic understanding of the structure and properties of organic magnetic molecules. After a summary of the phenomenon of magnetism at the molecular level, it presents a survey of the challenges to theoretical description and evaluation of the magnetic character of open-shell molecules, and an overview of recently developed methods and their successes and shortfalls. Several fields of application, including very strong organic molecular magnets and photo-magnetic switches, are surveyed. Finally, discussions on metal-based materials and simultaneously semiconducting and ferromagnetic extended systems and solids point the way toward future advances.The reader will find a comprehensive discourse on current understanding of magnetic molecules, a thorough survey of computational methods of characterizing known and imagined molecules, simple rules for design of larger magnetic systems, and a guide to opportunities for progress toward organic magnets.


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