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Author : Robert Sanderson Mulliken
Publisher :
ISBN 13 :
Total Pages : 610 pages
Book Rating : 4.:/5 (43 download)
Download or read book Molecular Orbitals in Chemistry, Physics, and Biology written by Robert Sanderson Mulliken and published by . This book was released on 1964 with total page 610 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Author : Bernard Pullman
Publisher :
ISBN 13 :
Total Pages : 578 pages
Book Rating : 4.:/5 (959 download)
Download or read book Molecular Orbitals in Chemistry, Physics, and Biology written by Bernard Pullman and published by . This book was released on 2000 with total page 578 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Author : J. Maruani
Publisher : Springer Science & Business Media
ISBN 13 : 9400928513
Total Pages : 699 pages
Book Rating : 4.4/5 (9 download)
Download or read book Molecules in Physics, Chemistry, and Biology written by J. Maruani and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 699 pages. Available in PDF, EPUB and Kindle. Book excerpt: Volume 1: General Introduction to Molecular Sciences Volume 2: Physical Aspects of Molecular Systems Volume 3: Electronic Structure and Chemical Reactivity Volume 4: Molecular Phenomena in Biological Sciences
Author : Jean Maruani
Publisher : Springer Science & Business Media
ISBN 13 : 9789027725981
Total Pages : 466 pages
Book Rating : 4.7/5 (259 download)
Download or read book Molecules in Physics, Chemistry, and Biology written by Jean Maruani and published by Springer Science & Business Media. This book was released on 1988-12-31 with total page 466 pages. Available in PDF, EPUB and Kindle. Book excerpt: Volume 1: General Introduction to Molecular Sciences Volume 2: Physical Aspects of Molecular Systems Volume 3: Electronic Structure and Chemical Reactivity Volume 4: Molecular Phenomena in Biological Sciences
Author : J. Maruani
Publisher : Springer
ISBN 13 :
Total Pages : 732 pages
Book Rating : 4.3/5 (91 download)
Download or read book Molecules in Physics, Chemistry and Biology written by J. Maruani and published by Springer. This book was released on 1988-10-31 with total page 732 pages. Available in PDF, EPUB and Kindle. Book excerpt: 'The book merits a place in any Science Library and I recommend it to anyone who shares the obvious fascination of the writers with molecules and accepts that molecular properties are often best described with the aid of mathematical expressions.' M. Godfrey, Journal of Electroanalytical Chemistry, 269 (1989) ' provide a panoramic view of the status and potential of molecular sciences at the end of the nineteen eighties. This four-volume set represents a great value for any scientific library or private collections. creating a broad-based and rich mini-series on molecular sciences.' Structural Chemistry, 1:5
Author : Victor M. S. Gil
Publisher : Cambridge University Press
ISBN 13 : 9780521666497
Total Pages : 336 pages
Book Rating : 4.6/5 (664 download)
Download or read book Orbitals in Chemistry written by Victor M. S. Gil and published by Cambridge University Press. This book was released on 2000-08-10 with total page 336 pages. Available in PDF, EPUB and Kindle. Book excerpt: This text presents a unified and up-to-date discussion of the role of atomic and molecular orbitals in chemistry, from the quantum mechanical foundations to the recent developments and applications. The discussion is mainly qualitative, largely based on symmetry arguments. It is felt that a sound mastering of the concepts and qualitative interpretations is needed, especially when students are becoming more and more familiar with numerical calculations based on atomic and molecular orbitals. The text is mathematically less demanding than most traditional quantum chemistry books but still retains clarity and rigour. The physical insight is maximized and abundant illustrations are used. The relationships between the more formal quantum mechanical formalisms and the traditional chemical descriptions of chemical bonding are critically established. This book is of primary interest to undergraduate chemistry students and others taking courses of which chemistry is a significant part.
Author : Anne-Marie Sapse
Publisher : Oxford University Press
ISBN 13 : 0195356845
Total Pages : 248 pages
Book Rating : 4.1/5 (953 download)
Download or read book Molecular Orbital Calculations for Biological Systems written by Anne-Marie Sapse and published by Oxford University Press. This book was released on 1998-11-12 with total page 248 pages. Available in PDF, EPUB and Kindle. Book excerpt: Molecular Orbital Calculations for Biological Systems is a hands-on guide to computational quantum chemistry and its applications in organic chemistry, biochemistry, and molecular biology. With improvements in software, molecular modeling techniques are now becoming widely available; they are increasingly used to complement experimental results, saving significant amounts of lab time. Common applications include pharmaceutical research and development; for example, ab initio and semi-empirical methods are playing important roles in peptide investigations and in drug design. The opening chapters provide an introduction for the non-quantum chemist to the basic quantum chemistry methods, ab initio, semi-empirical, and density functionals, as well as to one of the main families of computer programs, the Gaussian series. The second part then describes current research which applies quantum chemistry methods to such biological systems as amino acids, peptides, and anti-cancer drugs. Throughout the authors seek to encourage biochemists to discover aspects of their own research which might benefit from computational work. They also show that the methods are accessible to researchers from a wide range of mathematical backgrounds. Combining concise introductions with practical advice, this volume will be an invaluable tool for research on biological systems.
Author : Ian Fleming
Publisher : John Wiley & Sons
ISBN 13 : 1119964652
Total Pages : 389 pages
Book Rating : 4.1/5 (199 download)
Download or read book Molecular Orbitals and Organic Chemical Reactions written by Ian Fleming and published by John Wiley & Sons. This book was released on 2011-08-31 with total page 389 pages. Available in PDF, EPUB and Kindle. Book excerpt: Winner of the PROSE Award for Chemistry & Physics 2010 Acknowledging the very best in professional and scholarly publishing, the annual PROSE Awards recognise publishers' and authors' commitment to pioneering works of research and for contributing to the conception, production, and design of landmark works in their fields. Judged by peer publishers, librarians, and medical professionals, Wiley are pleased to congratulate Professor Ian Fleming, winner of the PROSE Award in Chemistry and Physics for Molecular Orbitals and Organic Chemical Reactions. Molecular orbital theory is used by chemists to describe the arrangement of electrons in chemical structures. It is also a theory capable of giving some insight into the forces involved in the making and breaking of chemical bonds—the chemical reactions that are often the focus of an organic chemist's interest. Organic chemists with a serious interest in understanding and explaining their work usually express their ideas in molecular orbital terms, so much so that it is now an essential component of every organic chemist's skills to have some acquaintance with molecular orbital theory. Molecular Orbitals and Organic Chemical Reactions is both a simplified account of molecular orbital theory and a review of its applications in organic chemistry; it provides a basic introduction to the subject and a wealth of illustrative examples. In this book molecular orbital theory is presented in a much simplified, and entirely non-mathematical language, accessible to every organic chemist, whether student or research worker, whether mathematically competent or not. Topics covered include: Molecular Orbital Theory Molecular Orbitals and the Structures of Organic Molecules Chemical Reactions — How Far and How Fast Ionic Reactions — Reactivity Ionic Reactions — Stereochemistry Pericyclic Reactions Radical Reactions Photochemical Reactions Slides for lectures and presentations are available on the supplementary website: www.wiley.com/go/fleming_student Molecular Orbitals and Organic Chemical Reactions: Student Edition is an invaluable first textbook on this important subject for students of organic, physical organic and computational chemistry. The Reference Edition edition takes the content and the same non-mathematical approach of the Student Edition, and adds extensive extra subject coverage, detail and over 1500 references. The additional material adds a deeper understanding of the models used, and includes a broader range of applications and case studies. Providing a complete in-depth reference for a more advanced audience, this edition will find a place on the bookshelves of researchers and advanced students of organic, physical organic and computational chemistry. Further information can be viewed here. "These books are the result of years of work, which began as an attempt to write a second edition of my 1976 book Frontier Orbitals and Organic Chemical Reactions. I wanted to give a rather more thorough introduction to molecular orbitals, while maintaining my focus on the organic chemist who did not want a mathematical account, but still wanted to understand organic chemistry at a physical level. I'm delighted to win this prize, and hope a new generation of chemists will benefit from these books." -Professor Ian Fleming
Author : Timothy Clark
Publisher : Springer Science & Business Media
ISBN 13 : 3662131501
Total Pages : 110 pages
Book Rating : 4.6/5 (621 download)
Download or read book The Chemist’s Electronic Book of Orbitals written by Timothy Clark and published by Springer Science & Business Media. This book was released on 2013-11-11 with total page 110 pages. Available in PDF, EPUB and Kindle. Book excerpt: This CD-ROM and textbook package introduces chemistry students to the world of molecular orbitals using 3D and VRML representations. An overview of the basic chemistry and physics needed enables readers to move quickly onto the CD. The CD-ROM itself contains an extended interactive textbook and a broad selection of classical organic compounds and inorganic complex ligands complete with their orbitals. Moreover, interactive demonstrations allow students to alter relevant parameters and watch the change in the orbitals'characteristics or take a walk through this fascinating 3D world.
Author : G.H. Wagniere
Publisher : Springer Science & Business Media
ISBN 13 : 3642930506
Total Pages : 114 pages
Book Rating : 4.6/5 (429 download)
Download or read book Introduction to Elementary Molecular Orbital Theory and to Semiempirical Methods written by G.H. Wagniere and published by Springer Science & Business Media. This book was released on 2012-12-06 with total page 114 pages. Available in PDF, EPUB and Kindle. Book excerpt: These notes summarize in part lectures held regularly at the University of Zurich and, in the Summer of 1974, at the Semi nario Latinoamericano de QUimica Cuantica in Mexico. I am grateful to those who have encouraged me to publish these lec tures or have contributed to them by their suggestions. In particular, I wish to thank Professor J. Keller of the Univer sidad Nacional Autonoma in Mexico, Professor H. Labhart and Professor H. Fischer of the University of Zurich, as well as my former students Dr. J. Kuhn, Dr. W. Hug and Dr. R. Geiger. The aim of these notes is to provtde a summary and concise introduction to elementary molecular orbital theory, with an emphasis on semiempirical methods. Within the last decade the development and refinement of ab initio computations has tended to overshadow the usefulness of semiempirical methods. However, both approaches have their justification. Ab initio methods are designed for accurate predictions, at the expense of greater computational labor. The aim of semiempirical methods mainly lies in a semiquantitative classification of electronic pro perties and in the search for regularities within given classes of larger molecules. The reader is supposed to have had some previous basic instruc tion in quantum mechanics, such as is now offered in many uni versities to chemists in their third or fourth year of study. The bibliography should encourage the reader to consult other texts, in particular also selected publications in scientific journals.
Author : Lindholm E. (Einar)
Publisher : Springer
ISBN 13 :
Total Pages : 306 pages
Book Rating : 4.3/5 (91 download)
Download or read book Molecular Orbitals and Their Energies, Studied by the Semiempirical HAM Method written by Lindholm E. (Einar) and published by Springer. This book was released on 1985 with total page 306 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Author : Andrew Streitwieser
Publisher : John Wiley & Sons
ISBN 13 :
Total Pages : 520 pages
Book Rating : 4.3/5 (91 download)
Download or read book Molecular Orbital Theory for Organic Chemists written by Andrew Streitwieser and published by John Wiley & Sons. This book was released on 1961 with total page 520 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Author : Charles Stuart Mccaw
Publisher : World Scientific Publishing Company
ISBN 13 : 1783264160
Total Pages : 276 pages
Book Rating : 4.7/5 (832 download)
Download or read book Orbitals: With Applications In Atomic Spectra written by Charles Stuart Mccaw and published by World Scientific Publishing Company. This book was released on 2015-03-30 with total page 276 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book describes atomic orbitals at a level suitable for undergraduates in chemistry. The mathematical treatment is brought to life by many illustrations rendered from mathematical functions (no artists' impressions), including three-dimensional plots of angular functions, showing orbital phase, and contour plots of the wavefunctions that result from orbital hybridisation.Orbitals extends the key fundamental quantum properties to many-electron atoms, linear combinations of atomic orbitals, simple molecules, delocalised systems and atomic spectroscopy. By focusing on simple model systems, use of analogies and avoiding group theory the results are obtained from initial postulates without the need for sophisticated mathematics.
Author : R. B. Woodward
Publisher : Elsevier
ISBN 13 : 148328204X
Total Pages : 185 pages
Book Rating : 4.4/5 (832 download)
Download or read book The Conservation of Orbital Symmetry written by R. B. Woodward and published by Elsevier. This book was released on 2013-10-22 with total page 185 pages. Available in PDF, EPUB and Kindle. Book excerpt: The Conservation of Orbital Symmetry examines the principle of conservation of orbital symmetry and its use. The central content of the principle was that reactions occur readily when there is congruence between orbital symmetry characteristics of reactants and products, and only with difficulty when that congruence does not obtain—or to put it more succinctly, orbital symmetry is conserved in concerted reaction. This principle is expected to endure, whatever the language in which it may be couched, or whatever greater precision may be developed in its application and extension. The book opens with a review of the elementary aspects of the molecular orbital theory of bonding. This is followed by separate chapters on correlation diagrams, the conservation of orbital symmetry, theory of electrocyclic reactions, theory of cycloadditions and cycloreversions, and theory of sigmatropic reactions. Subsequent chapters deal with group transfers and eliminations; secondary conformational effects in concerted cycloaddition reactions; and generalized selection rules for pericyclic reactions.
Author : J.R. Van Wazer
Publisher : Elsevier
ISBN 13 : 032316112X
Total Pages : 117 pages
Book Rating : 4.3/5 (231 download)
Download or read book Electron Densities in Molecular and Molecular Orbitals written by J.R. Van Wazer and published by Elsevier. This book was released on 2012-12-02 with total page 117 pages. Available in PDF, EPUB and Kindle. Book excerpt: Electron Densities in Molecules and Molecular Orbitals aims to explain the subject of molecular orbitals without having to rely much on its mathematical aspect, making it more approachable to those who are new to quantum chemistry. The book covers topics such as orbitals in quantum-chemical calculations; electronic ionizations and transitions; molecular-orbital change distributions; orbital transformations and calculations not involving orbitals; and electron densities and shapes in atoms and molecules. Also included in the book are the cross-sectional plots of electron densities of compounds such as organic compounds like methane, ethane, and ethylene; monomeric lithium fluoride and monomeric methyl lithium; hydrogen cyanide and methinophosphide; and monomeric borane and diborane. The text is recommended for those who have begun taking an interest in quantum chemistry but do not wish to deal yet with the mathematics part of the subject.
Author : Kenichi Fukui
Publisher : World Scientific
ISBN 13 : 9810222416
Total Pages : 563 pages
Book Rating : 4.8/5 (12 download)
Download or read book Frontier Orbitals and Reaction Paths written by Kenichi Fukui and published by World Scientific. This book was released on 1997 with total page 563 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book is a collection of selected papers on the Frontier Orbital Theory by Nobel prizewinner Kenichi Fukui (Chemistry 1981), with introductory notes. It provides the basic concept and formulation of the theory, and the physical and chemical significance of the frontier orbital interactions in chemistry, together with many practical applications. The formulation of the Intrinsic Reaction Coordinate and applications to some simple systems are also presented. The aim of this volume is to show by what forces chemical reactions are driven and to demonstrate how the regio- and stereo-selectivities are determined in chemical reactions. Students and senior investigators will gain insight into the nature of chemical reactions and find out how quantum chemical calculations are connected with chemical intuition.
Author : A. Davison
Publisher :
ISBN 13 : 9783662180792
Total Pages : 136 pages
Book Rating : 4.1/5 (87 download)
Download or read book Molecular Orbitals written by A. Davison and published by . This book was released on 2014-09-01 with total page 136 pages. Available in PDF, EPUB and Kindle. Book excerpt:
