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Book
xiv, 682 pages : illustrations (some color) ; 26 cm
Chemistry & ChemEng Library (Swain)
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QD151.3 .M54 2014 Unknown
Book
ix, 314 p. : ill. ; 25 cm.
Chemistry & ChemEng Library (Swain)
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QD154 .P75 2013 Unknown
Book
xii, 475 pages : illustrations ; 25 cm
Chemistry & ChemEng Library (Swain)
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QD461 .R24 2013 Unknown
Book
xl, 1,213 p. : col. ill. ; 28 cm.
Chemistry & ChemEng Library (Swain)
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QD151.3 .H68 2012 Unknown
Book
xvi, 683 p. : ill ; 25 cm.
Chemistry & ChemEng Library (Swain)
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Chemistry & ChemEng Library (Swain) Status
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QD553 .Z36 2012 Unknown
Book
xxxi, 1,382 p. : ill ; 24 cm.
Chemistry & ChemEng Library (Swain)
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Chemistry & ChemEng Library (Swain) Status
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QD151.3 .W45 2012 Unknown
Book
xxii, 370 p. : ill ; 24 cm.
Chemistry & ChemEng Library (Swain)
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Chemistry & ChemEng Library (Swain) Status
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QD156 .S38 2012 Unknown
Book
ix, 218 p. : ill. ; 24 cm.
  • Part 1 Symmetry and groups: Symmetry-- Groups and representations. Part 2 Application of group theory to vibrational spectroscopy: Reducible representations-- Techniques of vibrational spectroscopy-- The vibrational spectrum of Xe(O)F4. Part 3 Application of group theory to structure and bonding: Fundamentals of molecular orbital theory-- H2O: Linear or angular? NH3: Planar or pyramidal? Octahedral complexes-- Ferrocene-- Appendices and index.
  • (source: Nielsen Book Data)
The basics of group theory and its applications to themes such as the analysis of vibrational spectra and molecular orbital theory are essential knowledge for the undergraduate student of inorganic chemistry. The second edition of Group Theory for Chemists uses diagrams and problem-solving to help students test and improve their understanding, including a new section on the application of group theory to electronic spectroscopy. Part one covers the essentials of symmetry and group theory, including symmetry, point groups and representations. Part two deals with the application of group theory to vibrational spectroscopy, with chapters covering topics such as reducible representations and techniques of vibrational spectroscopy. In part three, group theory as applied to structure and bonding is considered, with chapters on the fundamentals of molecular orbital theory, octahedral complexes and ferrocene among other topics. Additionally in the second edition, part four focuses on the application of group theory to electronic spectroscopy, covering symmetry and selection rules, terms and configurations and d-d spectra. Drawing on the author's extensive experience teaching group theory to undergraduates, Group Theory for Chemists provides a focused and comprehensive study of group theory and its applications which is invaluable to the student of chemistry as well as those in related fields seeking an introduction to the topic. * Provides a focused and comprehensive study of group theory and its applications, an invaluable resource to students of chemistry as well as those in related fields seeking an introduction to the topic* Presents diagrams and problem-solving exercises to help students improve their understanding, including a new section on the application of group theory to electronic spectroscopy* Reviews the essentials of symmetry and group theory, including symmetry, point groups and representations and the application of group theory to vibrational spectroscopy.
(source: Nielsen Book Data)
  • Part 1 Symmetry and groups: Symmetry-- Groups and representations. Part 2 Application of group theory to vibrational spectroscopy: Reducible representations-- Techniques of vibrational spectroscopy-- The vibrational spectrum of Xe(O)F4. Part 3 Application of group theory to structure and bonding: Fundamentals of molecular orbital theory-- H2O: Linear or angular? NH3: Planar or pyramidal? Octahedral complexes-- Ferrocene-- Appendices and index.
  • (source: Nielsen Book Data)
The basics of group theory and its applications to themes such as the analysis of vibrational spectra and molecular orbital theory are essential knowledge for the undergraduate student of inorganic chemistry. The second edition of Group Theory for Chemists uses diagrams and problem-solving to help students test and improve their understanding, including a new section on the application of group theory to electronic spectroscopy. Part one covers the essentials of symmetry and group theory, including symmetry, point groups and representations. Part two deals with the application of group theory to vibrational spectroscopy, with chapters covering topics such as reducible representations and techniques of vibrational spectroscopy. In part three, group theory as applied to structure and bonding is considered, with chapters on the fundamentals of molecular orbital theory, octahedral complexes and ferrocene among other topics. Additionally in the second edition, part four focuses on the application of group theory to electronic spectroscopy, covering symmetry and selection rules, terms and configurations and d-d spectra. Drawing on the author's extensive experience teaching group theory to undergraduates, Group Theory for Chemists provides a focused and comprehensive study of group theory and its applications which is invaluable to the student of chemistry as well as those in related fields seeking an introduction to the topic. * Provides a focused and comprehensive study of group theory and its applications, an invaluable resource to students of chemistry as well as those in related fields seeking an introduction to the topic* Presents diagrams and problem-solving exercises to help students improve their understanding, including a new section on the application of group theory to electronic spectroscopy* Reviews the essentials of symmetry and group theory, including symmetry, point groups and representations and the application of group theory to vibrational spectroscopy.
(source: Nielsen Book Data)
Chemistry & ChemEng Library (Swain)
Status of items at Chemistry & ChemEng Library (Swain)
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QD455.3 .G75 M65 2011 Unavailable At bindery Request
Book
xiv, 754 p. ; ill. ; 26 cm.
  • Please note this is the 3rd edition Table of Contents: 1. Introduction to Inorganic Chemistry. 2. Atomic Structure. 3. Simple Bonding Theory. 4. Symmetry and Group Theory. 5. Molecular Orbitals. 6. Acid-Base and Donor-Acceptor Chemistry. 7. The Crystalline Solid State. 8. Chemistry of the Main Group Elements. 9. Coordination Chemistry I: Structures and Isomers. 10. Coordination Chemistry II: Bonding. 11. Coordination Chemistry III: Electronic Spectra. 12. Coordination Chemistry IV: Reactions and Mechanisms. 13. Organometallic Chemistry. 14. Organometallic Reactions and Catalysis. 15. Parallels Between Main Group and Organometallic Chemistry. 16. Bioinorganic and Environmental Chemistry. Appendixes.
  • (source: Nielsen Book Data)
This highly readable text provides the essentials of Inorganic Chemistry at a level that is neither too high nor too low. Praised for its coverage of theoretical inorganic chemistry, it discusses molecular symmetry earlier than other texts and builds on this foundation in later chapters. Plenty of supporting book references encourage you to further explore topics of interest.
(source: Nielsen Book Data)
  • Please note this is the 3rd edition Table of Contents: 1. Introduction to Inorganic Chemistry. 2. Atomic Structure. 3. Simple Bonding Theory. 4. Symmetry and Group Theory. 5. Molecular Orbitals. 6. Acid-Base and Donor-Acceptor Chemistry. 7. The Crystalline Solid State. 8. Chemistry of the Main Group Elements. 9. Coordination Chemistry I: Structures and Isomers. 10. Coordination Chemistry II: Bonding. 11. Coordination Chemistry III: Electronic Spectra. 12. Coordination Chemistry IV: Reactions and Mechanisms. 13. Organometallic Chemistry. 14. Organometallic Reactions and Catalysis. 15. Parallels Between Main Group and Organometallic Chemistry. 16. Bioinorganic and Environmental Chemistry. Appendixes.
  • (source: Nielsen Book Data)
This highly readable text provides the essentials of Inorganic Chemistry at a level that is neither too high nor too low. Praised for its coverage of theoretical inorganic chemistry, it discusses molecular symmetry earlier than other texts and builds on this foundation in later chapters. Plenty of supporting book references encourage you to further explore topics of interest.
(source: Nielsen Book Data)
Chemistry & ChemEng Library (Swain)
Status of items at Chemistry & ChemEng Library (Swain)
Chemistry & ChemEng Library (Swain) Status
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QD151.3 .M54 2011 Unknown
QD151.3 .M54 2011 Unknown
Book
xxvi, 456 p. : ill. ; 25 cm.
  • Introduction Introductory Experiments Intermediate Experiments Advanced Experiments.
  • (source: Nielsen Book Data)
This is a classic brought up to date with new experiments using the latest methods. Modern spectroscopic techniques and current research topics make this an incomparable resource for undergraduate and graduate students, presenting a fascinating approach to inorganic chemistry by providing experiments that resemble real research. As a result, students learn to think in a research-oriented fashion and to research together in a group. The experiments have been thoroughly tested and safety instructions are included, while hazardous substances are replaced by less harmful ones. This new edition also has a special focus on environmentally friendly experiments.
(source: Nielsen Book Data)
  • Introduction Introductory Experiments Intermediate Experiments Advanced Experiments.
  • (source: Nielsen Book Data)
This is a classic brought up to date with new experiments using the latest methods. Modern spectroscopic techniques and current research topics make this an incomparable resource for undergraduate and graduate students, presenting a fascinating approach to inorganic chemistry by providing experiments that resemble real research. As a result, students learn to think in a research-oriented fashion and to research together in a group. The experiments have been thoroughly tested and safety instructions are included, while hazardous substances are replaced by less harmful ones. This new edition also has a special focus on environmentally friendly experiments.
(source: Nielsen Book Data)
Chemistry & ChemEng Library (Swain)
Status of items at Chemistry & ChemEng Library (Swain)
Chemistry & ChemEng Library (Swain) Status
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QD155 .I54 2010 Unknown
Book
xi, 510 p., [8] p. of plates : ill. (some col.) ; 25 cm.
  • Preface ix Contributors xi 1 Inorganic and Bioinorganic Spectroscopy 1 Edward I. Solomon and Caleb B. Bell III 2 57 Fe Mossbauer Spectroscopy in Chemistry and Biology 39 Marlene Martinho and Eckard Munck 3 Magnetochemical Methods and Models in Inorganic Chemistry 69 Paul Kogerler 4 Cryoradiolysis as a Method for Mechanistic Studies in Inorganic Biochemistry 109 Ilia G. Denisov 5 Absolute Chiral Structures of Inorganic Compounds 143 James P. Riehl and Sumio Kaizaki 6 Flash Photolysis and Chemistry of Transients and Excited States 199 Guillermo Ferraudi 7 Application of High Pressure in the Elucidation of Inorganic and Bioinorganic Reaction Mechanisms 269 Colin D. Hubbard and Rudi van Eldik 8 Chemical Kinetics as a Mechanistic Tool 367 Andreja Bakac 9 Heavy AtomIsotope Effects as Probes of Small Molecule Activation 425 Justine P. Roth 10 Computational Studies of Reactivity inTransition Metal Chemistry 459 Jeremy N. Harvey Index 501.
  • (source: Nielsen Book Data)
Physical Inorganic Chemistry contains the fundamentals of physical inorganic chemistry, including information on reaction types, and treatments of reaction mechanisms. Additionally, the text explores complex reactions and processes in terms of energy, environment, and health. This valuable resource closely examines mechanisms, an under-discussed topic. Divided into two sections, researchers, professors, and students will find the wide range of topics, including the most cutting edge topics in chemistry, like the future of solar energy, catalysis, environmental issues, climate changes atmosphere, and human health, essential to understanding chemistry.
(source: Nielsen Book Data)
  • Preface ix Contributors xi 1 Inorganic and Bioinorganic Spectroscopy 1 Edward I. Solomon and Caleb B. Bell III 2 57 Fe Mossbauer Spectroscopy in Chemistry and Biology 39 Marlene Martinho and Eckard Munck 3 Magnetochemical Methods and Models in Inorganic Chemistry 69 Paul Kogerler 4 Cryoradiolysis as a Method for Mechanistic Studies in Inorganic Biochemistry 109 Ilia G. Denisov 5 Absolute Chiral Structures of Inorganic Compounds 143 James P. Riehl and Sumio Kaizaki 6 Flash Photolysis and Chemistry of Transients and Excited States 199 Guillermo Ferraudi 7 Application of High Pressure in the Elucidation of Inorganic and Bioinorganic Reaction Mechanisms 269 Colin D. Hubbard and Rudi van Eldik 8 Chemical Kinetics as a Mechanistic Tool 367 Andreja Bakac 9 Heavy AtomIsotope Effects as Probes of Small Molecule Activation 425 Justine P. Roth 10 Computational Studies of Reactivity inTransition Metal Chemistry 459 Jeremy N. Harvey Index 501.
  • (source: Nielsen Book Data)
Physical Inorganic Chemistry contains the fundamentals of physical inorganic chemistry, including information on reaction types, and treatments of reaction mechanisms. Additionally, the text explores complex reactions and processes in terms of energy, environment, and health. This valuable resource closely examines mechanisms, an under-discussed topic. Divided into two sections, researchers, professors, and students will find the wide range of topics, including the most cutting edge topics in chemistry, like the future of solar energy, catalysis, environmental issues, climate changes atmosphere, and human health, essential to understanding chemistry.
(source: Nielsen Book Data)
Chemistry & ChemEng Library (Swain)
Status of items at Chemistry & ChemEng Library (Swain)
Chemistry & ChemEng Library (Swain) Status
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QD475 .P49 2010 Unknown
Book
xxiv, 824 p. : ill. (chielfy col.) ; 28 cm.
  • PART 1. FOUNDATIONS-- 1. Atomic structure-- 2. Molecular structure and bonding-- 3. The structures of simple solids-- 4. Acids and bases-- 5. Oxidation and reduction-- 6. Molecular symmetry-- 7. An introduction to coordination compounds-- 8. Physical techniques in inorganic chemistry-- PART 2. THE ELEMENTS AND THEIR COMPOUNDS-- 9. Periodic trends-- 10. Hydrogen-- 11. The group 1 elements-- 12. The group 2 elements-- 13. The group 13 elements-- 14. The group 14 elements-- 15. The group 15 elements-- 16. The group 16 elements-- 17. The group 17 elements-- 18. The group 18 elements-- 19. The d-block elements-- 20. d-Metal complexes: electronic structure and properties-- 21. Coordination chemistry: reactions of complexes-- 22. d-Metal organometallic chemistry-- 23. the f-block elements-- PART 3. FRONTIERS-- 24. Solid state and materials chemistry-- 25. Nanomaterials, nanoscience, and nanotechnology-- 26. Catalysis-- 27. Biological inorganic chemistry.
  • (source: Nielsen Book Data)
Shriver and Atkins' Inorganic Chemistry fifth edition represents an integral part of a student's chemistry education. With the same broad coverage as its predecessors - making it the ideal companion for the duration of an undergraduate degree programme - the fifth edition extends from the foundational concepts of inorganic chemistry to the forefront of contemporary research. The book seeks not just to impart knowledge, but to engage and enthuse its readers. Its unique 'Frontiers' chapters cover materials science, nanotechnology, catalysis, and biological inorganic chemistry, and have been fully updated to reflect advances in these key areas of contemporary research and industrial application. Further, examples throughout show the relevance of inorganic chemistry to real-life situations, to encourage students to engage fully with the subject. Inorganic chemistry spans a huge range of elements, whose characteristic similarities and differences students must be familiar with. Inorganic Chemistry rises to this challenge by setting out the key trends exhibited within the periodic table, and by the elements comprising each Group. These trends and behaviours are illuminated with illustrative examples, placing the content in a clear, relevant context. The Online Resource Centre contains 3D rotating molecular models, illustrations from the book in electronic format, web links, and additional questions. A solutions manual is available at no cost to adopters.
(source: Nielsen Book Data)
  • PART 1. FOUNDATIONS-- 1. Atomic structure-- 2. Molecular structure and bonding-- 3. The structures of simple solids-- 4. Acids and bases-- 5. Oxidation and reduction-- 6. Molecular symmetry-- 7. An introduction to coordination compounds-- 8. Physical techniques in inorganic chemistry-- PART 2. THE ELEMENTS AND THEIR COMPOUNDS-- 9. Periodic trends-- 10. Hydrogen-- 11. The group 1 elements-- 12. The group 2 elements-- 13. The group 13 elements-- 14. The group 14 elements-- 15. The group 15 elements-- 16. The group 16 elements-- 17. The group 17 elements-- 18. The group 18 elements-- 19. The d-block elements-- 20. d-Metal complexes: electronic structure and properties-- 21. Coordination chemistry: reactions of complexes-- 22. d-Metal organometallic chemistry-- 23. the f-block elements-- PART 3. FRONTIERS-- 24. Solid state and materials chemistry-- 25. Nanomaterials, nanoscience, and nanotechnology-- 26. Catalysis-- 27. Biological inorganic chemistry.
  • (source: Nielsen Book Data)
Shriver and Atkins' Inorganic Chemistry fifth edition represents an integral part of a student's chemistry education. With the same broad coverage as its predecessors - making it the ideal companion for the duration of an undergraduate degree programme - the fifth edition extends from the foundational concepts of inorganic chemistry to the forefront of contemporary research. The book seeks not just to impart knowledge, but to engage and enthuse its readers. Its unique 'Frontiers' chapters cover materials science, nanotechnology, catalysis, and biological inorganic chemistry, and have been fully updated to reflect advances in these key areas of contemporary research and industrial application. Further, examples throughout show the relevance of inorganic chemistry to real-life situations, to encourage students to engage fully with the subject. Inorganic chemistry spans a huge range of elements, whose characteristic similarities and differences students must be familiar with. Inorganic Chemistry rises to this challenge by setting out the key trends exhibited within the periodic table, and by the elements comprising each Group. These trends and behaviours are illuminated with illustrative examples, placing the content in a clear, relevant context. The Online Resource Centre contains 3D rotating molecular models, illustrations from the book in electronic format, web links, and additional questions. A solutions manual is available at no cost to adopters.
(source: Nielsen Book Data)
Chemistry & ChemEng Library (Swain)
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QD151.5 .S57 2010 Unknown
Book
vii, 201 p. : ill. ; 28 cm.
Chemistry & ChemEng Library (Swain)
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QD151.5 .S57 2010B Unavailable Assumed lost Request
Book
1 v. (various pagings) : ill. ; 28 cm.
Chemistry & ChemEng Library (Swain)
Status of items at Chemistry & ChemEng Library (Swain)
Chemistry & ChemEng Library (Swain) Status
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QD151.3 .S65 2009 Unknown
Book
xv, 594 p. : ill. (some col.) ; 29 cm.
  • List of Contributors. Series Preface. Volume Preface. Part 1: Methods. Calculation of Bonding Properties (Gernot Frenking and Moritz von Hopffgarden). Determining Transition States in Bioinorganic Reactions (Marcus Lundberg and Keiji Morokuma). Quantum Mechanical/Molecular Mechanical (QM/MM) Methods and Applications in Bioinorganic Chemistry (Ulf Ryde). Ab initio and Semiempirical Methods (Serge I. Gorelsky). Spectroscopic Properties of Proten-Bound Cofactors: Calculation by Combined Quantum Mechanical/Molecular Mechanical (QM/MM) Approaches (Mahesh Sundararajan, Christoph Riplinger, Maylis Orio, Frank Wennmohs and Frank Neese). Spectroscopic Properties Obtained from Time-Dependent Density Functional Theory (TD-DFT) (Jochen Autschbach). Nuclear Magnetic Resonance (NMR) Parameters of Transition Metal Complexes: Methods and Applications (Martin Kaupp and Michael Buhl). Calculation of Reduction Potential and pKa. Quantum-Chemistry-Centered Normal Coordinate Analysis (QCC-NCA): Application of NCA for the Simulation of the Vibrational Spectra of Large Molecules (Nicolai Lehnert). Molecular Mechanics in Bioinorganic Chemistry (Robert J. Deeth). Multiconfigurational Quantum Mechanics (QM) for Heavy Element Compounds (Bjorn O. Roos). Approximate Density Functionals: Which Should I Choose? (Dmitrij Rappoport, Nathan R. M. Crawford, Filipp Furche and Kieron Burke). Spin Contamination in Inorganic Chemistry Calculations (Jason L. Sonnerberg, H. Bernhard Schlegel and Hrant P. Hratchian). Gaussian Basis Sets for Quantum Mechanical (QM) Calculations (Kirk A. Peterson). Part 2: Case Studies - Bioinorganic. Modeling Metalloenzymes with Density Functional and Mixed Quantum Mechanical/Molecular Mechanical (QM/MM) Calculations: Progress and Challenges (Richard A. Friesner). Broken Symmetry States of Iron-Sulfur Clusters (Louis Noodleman and David A. Case). Water Oxidation by the Manganese Cluster in Photosynthesis (Per E. M. Siegbahn). Nature of the Catecholate-Fe(III) Bond: High Affinity Binding and Substrate Activation in Bioinorganic Chemistry (Edward I. Solomon, Monita Y. M. Pau and Rosalie K. Hocking). Computational Studies: B12 Cofactors and Their Interaction with Enzyme Active Sites (Thomas C. Brunold). Reaction Coordinate of Pyranopterin Molybdenum Enzymes (Martin L. Kirk, Sushilla Knottenbelt and Abebe Habtegabre). Electronic Structure Calculations: Dinitrogen Reduction in Nitrogenase and Synthetic Model Systems (Felix Tuczek). Hydrogenases: Theoretical Investigations Towards Bioinspired H2 Production and Activation (Maurizio Bruschi, Giuseppe Zampella, Claudio Grego, Luca Bertini, Piercarlo Fantucci and Luca De Gioia). Computational Studies: Cisplatin (Yogita Mantri and Mu-Hyun Baik). Computational Methods: Modeling of Reactivity in Zn-Containing Enzymes (Jon I. Mujika, Adrian J. Mulholland and Jeremy N. Harvey). Combined Density Functional Theory (DFT) and Electrostatics Study of the Proton Pumping Mechanism in Cytochrome c Oxidase (Jason Quenneville, Dragan M. Popovi& and Alexei A. Stuchebrukhov). Computational Studies: Proton/Water Coupling to Metal in Biological Reaction Mechanisms (Y. Bu and R. I. Cukier). Computational Studies: Chemical Evolution of Metal Sites (Kasper P. Jensen). Part 3: Case Studies - Inorganic. Electronic Structure Calculations: Transition Metal-NO Complexes (Abhik Ghosh, Jeanet Conradie and Kathrin H. Hopmann). Structural Origins of Noninnocent Coordination Chemistry (Robert K. Szilagyi). Electronic Structure of Metal-Metal Bonds (John E. McGrady). Computational Methods: Transition Metal Clusters (Regis Gautier, Jean-Francois Halet and Jean-Yves Saillard). Computational Methods: Heteropolyoxoanions (Josep M. Poblet and Xavier Lopez). Electronic Structure Calculations: Metal Carbonyls (Chantal Daniel). Potential Energy Surfaces for Metal-Assisted Chemical Reactions (Tiziana Marino, Maria del Carmen Michelini, Nino Russo, Emilia Sicilia and Marirosa Toscano). Computational Methods: Lanthanides and Actinides (M. Dolg and X. Cao). Spin-Orbit Coupling: Effects in Heavy Element Chemistry (Nikolas Kaltsoyannis). Noble Gas Compounds: Reliable Computational Methods (David A. Dixon). Computational Studies: Boranes (Oottikkal Shameema and Eluvathingal D. Jemmis). Multiple Aromaticity, Multiple Antiaromaticity, and Conflicting Aromaticity in Inorganic Systems (Dmitry Yu. Zubarev and Aledander I. Boldyrev). Theoretical Aspects of Main Group Multiple Bonded Systems (Ioan Silaghi-Dumitrescu, Petronela Petrar, Gabriela Nemes and R. Bruce King). Index.
  • (source: Nielsen Book Data)
A much-needed integration of inorganic chemistry with computational strategies and methods, this resource focuses on applications for inorganic and bioinorganic systems. The coverage helps to understand the spectroscopy and function of enzymes and related compounds, and provides a snapshot of the state-of-the-art in application of computational techniques to (bio)inorganic systems. Expert authors in the area provide practical descriptions of the methods employed and describe case studies in a number of areas of current research in which these methods have made an essential contribution.
(source: Nielsen Book Data)
  • List of Contributors. Series Preface. Volume Preface. Part 1: Methods. Calculation of Bonding Properties (Gernot Frenking and Moritz von Hopffgarden). Determining Transition States in Bioinorganic Reactions (Marcus Lundberg and Keiji Morokuma). Quantum Mechanical/Molecular Mechanical (QM/MM) Methods and Applications in Bioinorganic Chemistry (Ulf Ryde). Ab initio and Semiempirical Methods (Serge I. Gorelsky). Spectroscopic Properties of Proten-Bound Cofactors: Calculation by Combined Quantum Mechanical/Molecular Mechanical (QM/MM) Approaches (Mahesh Sundararajan, Christoph Riplinger, Maylis Orio, Frank Wennmohs and Frank Neese). Spectroscopic Properties Obtained from Time-Dependent Density Functional Theory (TD-DFT) (Jochen Autschbach). Nuclear Magnetic Resonance (NMR) Parameters of Transition Metal Complexes: Methods and Applications (Martin Kaupp and Michael Buhl). Calculation of Reduction Potential and pKa. Quantum-Chemistry-Centered Normal Coordinate Analysis (QCC-NCA): Application of NCA for the Simulation of the Vibrational Spectra of Large Molecules (Nicolai Lehnert). Molecular Mechanics in Bioinorganic Chemistry (Robert J. Deeth). Multiconfigurational Quantum Mechanics (QM) for Heavy Element Compounds (Bjorn O. Roos). Approximate Density Functionals: Which Should I Choose? (Dmitrij Rappoport, Nathan R. M. Crawford, Filipp Furche and Kieron Burke). Spin Contamination in Inorganic Chemistry Calculations (Jason L. Sonnerberg, H. Bernhard Schlegel and Hrant P. Hratchian). Gaussian Basis Sets for Quantum Mechanical (QM) Calculations (Kirk A. Peterson). Part 2: Case Studies - Bioinorganic. Modeling Metalloenzymes with Density Functional and Mixed Quantum Mechanical/Molecular Mechanical (QM/MM) Calculations: Progress and Challenges (Richard A. Friesner). Broken Symmetry States of Iron-Sulfur Clusters (Louis Noodleman and David A. Case). Water Oxidation by the Manganese Cluster in Photosynthesis (Per E. M. Siegbahn). Nature of the Catecholate-Fe(III) Bond: High Affinity Binding and Substrate Activation in Bioinorganic Chemistry (Edward I. Solomon, Monita Y. M. Pau and Rosalie K. Hocking). Computational Studies: B12 Cofactors and Their Interaction with Enzyme Active Sites (Thomas C. Brunold). Reaction Coordinate of Pyranopterin Molybdenum Enzymes (Martin L. Kirk, Sushilla Knottenbelt and Abebe Habtegabre). Electronic Structure Calculations: Dinitrogen Reduction in Nitrogenase and Synthetic Model Systems (Felix Tuczek). Hydrogenases: Theoretical Investigations Towards Bioinspired H2 Production and Activation (Maurizio Bruschi, Giuseppe Zampella, Claudio Grego, Luca Bertini, Piercarlo Fantucci and Luca De Gioia). Computational Studies: Cisplatin (Yogita Mantri and Mu-Hyun Baik). Computational Methods: Modeling of Reactivity in Zn-Containing Enzymes (Jon I. Mujika, Adrian J. Mulholland and Jeremy N. Harvey). Combined Density Functional Theory (DFT) and Electrostatics Study of the Proton Pumping Mechanism in Cytochrome c Oxidase (Jason Quenneville, Dragan M. Popovi& and Alexei A. Stuchebrukhov). Computational Studies: Proton/Water Coupling to Metal in Biological Reaction Mechanisms (Y. Bu and R. I. Cukier). Computational Studies: Chemical Evolution of Metal Sites (Kasper P. Jensen). Part 3: Case Studies - Inorganic. Electronic Structure Calculations: Transition Metal-NO Complexes (Abhik Ghosh, Jeanet Conradie and Kathrin H. Hopmann). Structural Origins of Noninnocent Coordination Chemistry (Robert K. Szilagyi). Electronic Structure of Metal-Metal Bonds (John E. McGrady). Computational Methods: Transition Metal Clusters (Regis Gautier, Jean-Francois Halet and Jean-Yves Saillard). Computational Methods: Heteropolyoxoanions (Josep M. Poblet and Xavier Lopez). Electronic Structure Calculations: Metal Carbonyls (Chantal Daniel). Potential Energy Surfaces for Metal-Assisted Chemical Reactions (Tiziana Marino, Maria del Carmen Michelini, Nino Russo, Emilia Sicilia and Marirosa Toscano). Computational Methods: Lanthanides and Actinides (M. Dolg and X. Cao). Spin-Orbit Coupling: Effects in Heavy Element Chemistry (Nikolas Kaltsoyannis). Noble Gas Compounds: Reliable Computational Methods (David A. Dixon). Computational Studies: Boranes (Oottikkal Shameema and Eluvathingal D. Jemmis). Multiple Aromaticity, Multiple Antiaromaticity, and Conflicting Aromaticity in Inorganic Systems (Dmitry Yu. Zubarev and Aledander I. Boldyrev). Theoretical Aspects of Main Group Multiple Bonded Systems (Ioan Silaghi-Dumitrescu, Petronela Petrar, Gabriela Nemes and R. Bruce King). Index.
  • (source: Nielsen Book Data)
A much-needed integration of inorganic chemistry with computational strategies and methods, this resource focuses on applications for inorganic and bioinorganic systems. The coverage helps to understand the spectroscopy and function of enzymes and related compounds, and provides a snapshot of the state-of-the-art in application of computational techniques to (bio)inorganic systems. Expert authors in the area provide practical descriptions of the methods employed and describe case studies in a number of areas of current research in which these methods have made an essential contribution.
(source: Nielsen Book Data)
Chemistry & ChemEng Library (Swain)
Status of items at Chemistry & ChemEng Library (Swain)
Chemistry & ChemEng Library (Swain) Status
Stacks
QP517 .Q34 C66 2009 Unknown
Book
xx, 819 p. : ill. ; 26 cm.
  • PART I-- Fundamentals of Bonding Theory-- 1. Introduction to Quantum Theory-- 2. The Electronic Structure of Atoms-- 3. Covalent Bonding in Molecules-- 4. Chemical Bonding in Condensed Phases-- 5. Computational Chemistry-- PART II-- Symmetry in Chemistry-- 6. Symmetry and Elements of Group Theory-- 7. Application of Group Theory to Molecular Systems-- 8. Bonding in Coordination Compounds-- 9. Symmetry in Crystals-- 10. Basic Inorganic Crystal Structures and Materials-- PART III-- Structural Chemistry of Selected Elements-- 11. Structural Chemistry of Hydrogen-- 12. Structural Chemistry of Alkali and Alkali-Earth Metals-- 13. Structural Chemistry of Group 13 Elements-- 14. Structural Chemistry of Group 14 Elements-- 15. Structural Chemistry of Group 15 Elements-- 16. Structural Chemistry of Group 16 Elements-- 17. Structural Chemistry of Group 17 and Group 18 Elements-- 18. Structural Chemistry of Rare-Earth Elements-- 19. Metal-Metal Bonds and Transition-Metal Clusters-- 20. Supramolecular Structural Chemistry.
  • (source: Nielsen Book Data)
This book is a revised and updated English edition of a textbook that has grown out of several years of teaching. The term "inorganic" is used in a broad sense as the book covers the structural chemistry of representative elements (including carbon) in the periodic table, organometallics, coordination polymers, host-guest systems and supramolecular assemblies. Part I of the book reviews the basic bonding theories, including a chapter on computational chemistry. Part II introduces point groups and space groups and their chemical applications. Part III comprises a succinct account of the structural chemistry of the elements in the periodic table. It presents structure and bonding, generalizations of structural trends, crystallographic data, as well as highlights from the recent literature.
(source: Nielsen Book Data)
  • PART I-- Fundamentals of Bonding Theory-- 1. Introduction to Quantum Theory-- 2. The Electronic Structure of Atoms-- 3. Covalent Bonding in Molecules-- 4. Chemical Bonding in Condensed Phases-- 5. Computational Chemistry-- PART II-- Symmetry in Chemistry-- 6. Symmetry and Elements of Group Theory-- 7. Application of Group Theory to Molecular Systems-- 8. Bonding in Coordination Compounds-- 9. Symmetry in Crystals-- 10. Basic Inorganic Crystal Structures and Materials-- PART III-- Structural Chemistry of Selected Elements-- 11. Structural Chemistry of Hydrogen-- 12. Structural Chemistry of Alkali and Alkali-Earth Metals-- 13. Structural Chemistry of Group 13 Elements-- 14. Structural Chemistry of Group 14 Elements-- 15. Structural Chemistry of Group 15 Elements-- 16. Structural Chemistry of Group 16 Elements-- 17. Structural Chemistry of Group 17 and Group 18 Elements-- 18. Structural Chemistry of Rare-Earth Elements-- 19. Metal-Metal Bonds and Transition-Metal Clusters-- 20. Supramolecular Structural Chemistry.
  • (source: Nielsen Book Data)
This book is a revised and updated English edition of a textbook that has grown out of several years of teaching. The term "inorganic" is used in a broad sense as the book covers the structural chemistry of representative elements (including carbon) in the periodic table, organometallics, coordination polymers, host-guest systems and supramolecular assemblies. Part I of the book reviews the basic bonding theories, including a chapter on computational chemistry. Part II introduces point groups and space groups and their chemical applications. Part III comprises a succinct account of the structural chemistry of the elements in the periodic table. It presents structure and bonding, generalizations of structural trends, crystallographic data, as well as highlights from the recent literature.
(source: Nielsen Book Data)
dx.doi.org Oxford Scholarship Online
Chemistry & ChemEng Library (Swain)
Status of items at Chemistry & ChemEng Library (Swain)
Chemistry & ChemEng Library (Swain) Status
Stacks
QD475 .L5 2008 Unknown

17. Inorganic chemistry [2008]

Book
xxxvii, 1098 p. : ill. (chiefly col.) ; 28 cm.
  • Preface Acknowledgements 1 Basic concepts: atoms 2 Basic concepts: molecules 3 Nuclear properties 4 An introduction to molecular symmetry 5 Bonding in polyatomic molecules 6 Structures and energetics of metallic and ionic solids 7 Acids, bases and ions in aqueous solution 8 Reduction and oxidation 9 Non-aqueous media 10 Hydrogen 11 Group 1: the alkali metals 12 The group 2 metals 13 The group 13 elements 14 The group 14 elements 15 The group 15 elements 16 The group 16 elements 17 The group 17 elements 18 The group 18 elements 19 Organometallic compounds of s- and p- block elements 20 d-Block chemistry: general considerations 21 d-Block metal chemistry: coordination complexes 22 d-Block chemistry: the first row metals 23 d-Block metal chemistry: the second and third row metals 24 Organometallic compunds of d-block elements 25 The f-block metals: lanthanoids and actinoids 26 d-Block metal complexes: reaction mechanisms 27 Catalysis and some industrial processes 28 Some aspects of solid state chemistry 29 The trace metals of life Appendices Answers to non-descriptive problems Index.
  • (source: Nielsen Book Data)
A market leading textbook offering a fresh and engaging approach to the teaching of modern inorganic chemistry while giving a clear, well-balanced introduction to the key principles of the subject. The full-colour text design with three dimensional illustrations brings the subject to life. Throughout the book students are able to reinforce their learning with the use of worked examples and self-study exercises. Numerous applications and topic boxes also relate the chemistry to everyday life.
(source: Nielsen Book Data)
  • Preface Acknowledgements 1 Basic concepts: atoms 2 Basic concepts: molecules 3 Nuclear properties 4 An introduction to molecular symmetry 5 Bonding in polyatomic molecules 6 Structures and energetics of metallic and ionic solids 7 Acids, bases and ions in aqueous solution 8 Reduction and oxidation 9 Non-aqueous media 10 Hydrogen 11 Group 1: the alkali metals 12 The group 2 metals 13 The group 13 elements 14 The group 14 elements 15 The group 15 elements 16 The group 16 elements 17 The group 17 elements 18 The group 18 elements 19 Organometallic compounds of s- and p- block elements 20 d-Block chemistry: general considerations 21 d-Block metal chemistry: coordination complexes 22 d-Block chemistry: the first row metals 23 d-Block metal chemistry: the second and third row metals 24 Organometallic compunds of d-block elements 25 The f-block metals: lanthanoids and actinoids 26 d-Block metal complexes: reaction mechanisms 27 Catalysis and some industrial processes 28 Some aspects of solid state chemistry 29 The trace metals of life Appendices Answers to non-descriptive problems Index.
  • (source: Nielsen Book Data)
A market leading textbook offering a fresh and engaging approach to the teaching of modern inorganic chemistry while giving a clear, well-balanced introduction to the key principles of the subject. The full-colour text design with three dimensional illustrations brings the subject to life. Throughout the book students are able to reinforce their learning with the use of worked examples and self-study exercises. Numerous applications and topic boxes also relate the chemistry to everyday life.
(source: Nielsen Book Data)
Chemistry & ChemEng Library (Swain)
Status of items at Chemistry & ChemEng Library (Swain)
Chemistry & ChemEng Library (Swain) Status
Stacks
QD151.3 .H68 2008 Unknown
Book
xvi, 840 p. : ill. (some col.) ; 29 cm.
Connecting inorganic chemistry to the hottest topic in materials science, this timely resource collects the contributions made by leading inorganic chemists towards nanomaterials research. The second volume in the "Wiley Encyclopedia of Inorganic Chemistry Methods and Applications Series, " this signature title concentrates on recent developments in the field and includes all key topics such as nanowires, nanotubes, biomineralization, supramolecular materials and much more.
(source: Nielsen Book Data)
Connecting inorganic chemistry to the hottest topic in materials science, this timely resource collects the contributions made by leading inorganic chemists towards nanomaterials research. The second volume in the "Wiley Encyclopedia of Inorganic Chemistry Methods and Applications Series, " this signature title concentrates on recent developments in the field and includes all key topics such as nanowires, nanotubes, biomineralization, supramolecular materials and much more.
(source: Nielsen Book Data)
Chemistry & ChemEng Library (Swain)
Status of items at Chemistry & ChemEng Library (Swain)
Chemistry & ChemEng Library (Swain) Status
Stacks
QD151.3 .N36 2008 Unavailable Assumed lost Request
Book
x, 809 p. : ill. ; 29 cm.
  • 1. Critical Properties and Acentric Factor - Organic Compound 2. Critical Properties and Acentric Factor - Inorganic Compounds 3. Density of Liquid - Organic Compounds 4. Density of Liquid - Inorganic Compounds 5. Density of Solid - Organic Compounds 6. Density of Solid - Inorganic Compounds 7. Enthalpy of Vaporization - Organic Compounds 8. Enthalpy of Vaporization - Inorganic Compounds 9. Enthalpy of Vaporization at Boiling Point - Organic Compounds 10. Enthalpy of Vaporization at Boiling Point - Inorganic Compounds 11. Enthalpy of Fusion - Organic Compounds 12. Enthalpy of Fusion - Inorganic Compounds 13. Solubility Parameter and Liquid Volume - Organic Compounds 14. Solubility Parameter and Liquid Volume - Inorganic Compounds 15. Van Der Waals Area and Volume - Organic Compounds 16. Van Der Waals Area and Volume - Inorganic Compounds 17. Radius of Gyration - Organic Compounds 18. Radius of Gyration - Inorganic Compounds 19. Dipole Moment - Organic Compounds 20. Dipole Moment - Inorganic Compounds 21. Surface Tension - Organic Compounds 22. Surface Tension - Inorganic Compounds.
  • (source: Nielsen Book Data)
Carl Yaws, an authority on chemical compounds in the chemical engineering field, has done it again. His new book - essential to any chemist or chemical engineer's library - presents over 7,800 organic and inorganic chemicals, and hydrocarbons. Designed and formatted for field, lab or classroom usage, it provides unparalleled access to invaluable data.
(source: Nielsen Book Data)
  • 1. Critical Properties and Acentric Factor - Organic Compound 2. Critical Properties and Acentric Factor - Inorganic Compounds 3. Density of Liquid - Organic Compounds 4. Density of Liquid - Inorganic Compounds 5. Density of Solid - Organic Compounds 6. Density of Solid - Inorganic Compounds 7. Enthalpy of Vaporization - Organic Compounds 8. Enthalpy of Vaporization - Inorganic Compounds 9. Enthalpy of Vaporization at Boiling Point - Organic Compounds 10. Enthalpy of Vaporization at Boiling Point - Inorganic Compounds 11. Enthalpy of Fusion - Organic Compounds 12. Enthalpy of Fusion - Inorganic Compounds 13. Solubility Parameter and Liquid Volume - Organic Compounds 14. Solubility Parameter and Liquid Volume - Inorganic Compounds 15. Van Der Waals Area and Volume - Organic Compounds 16. Van Der Waals Area and Volume - Inorganic Compounds 17. Radius of Gyration - Organic Compounds 18. Radius of Gyration - Inorganic Compounds 19. Dipole Moment - Organic Compounds 20. Dipole Moment - Inorganic Compounds 21. Surface Tension - Organic Compounds 22. Surface Tension - Inorganic Compounds.
  • (source: Nielsen Book Data)
Carl Yaws, an authority on chemical compounds in the chemical engineering field, has done it again. His new book - essential to any chemist or chemical engineer's library - presents over 7,800 organic and inorganic chemicals, and hydrocarbons. Designed and formatted for field, lab or classroom usage, it provides unparalleled access to invaluable data.
(source: Nielsen Book Data)
Chemistry & ChemEng Library (Swain)
Status of items at Chemistry & ChemEng Library (Swain)
Chemistry & ChemEng Library (Swain) Status
Reference (non-circulating)
QD272 .T45 Y39 2008 In-library use
Book
xi, 576 p. : ill. (some col.) ; 29 cm.
Chemistry & ChemEng Library (Swain)
Status of items at Chemistry & ChemEng Library (Swain)
Chemistry & ChemEng Library (Swain) Status
Stacks
QD151.3 .A67 2007 Unknown

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