Symmetry in inorganic and coordination compounds : a student's guide to understanding electronic structure / Franca Morazzoni.

Author
Morazzoni, Franca [Browse]
Format
Book
Language
English
Published/​Created
  • Cham, Switzerland : Springer, [2021]
  • ©2021
Description
1 online resource (196 pages)

Details

Subject(s)
Series
Source of description
Description based on print version record.
Contents
  • Intro
  • Preface
  • Acknowledgements
  • Introduction
  • Contents
  • About the Author
  • 1 The Electronic Structure Determination
  • 1.1 Variation Method (Molecular Orbital Linear Combination of Atomic Orbitals, MO-LCAO)
  • 1.2 A Matrix Formulation of MO Calculations
  • 1.3 The Hückel Approximation
  • 1.3.1 The Case of the Allyl Anion (MO-LCAO by π Orbitals)
  • 1.4 The Extended Hückel Procedure
  • 1.5 Group Theory
  • 1.5.1 Rules for the Elements Which Constitute a Group
  • 1.5.2 Group Multiplication Tables
  • 1.5.3 Representation of Symmetry Operations by Matrices
  • 1.6 Irreducible Representations
  • 1.6.1 Character Table of groups
  • 1.6.2 Factoring the Total Representations into Irreducible Representation
  • 1.6.3 Relation Between Molecular Wave Functions and Irreducible Representations
  • 1.6.4 Obtaining Molecular Orbitals with a Given Symmetry
  • 2 Symmetry Orbitals for Different Bis and Polyatomic Molecules
  • 2.1 Homonuclear Diatomic Molecules A-A of the Periodic Table First Row
  • 2.2 Water Molecule, as Example of Triatomic Molecule
  • 2.3 Ammonia Molecule, as Example of Tetratomic Molecule
  • 2.4 Methane Molecule, as Example of Pentatomic Molecule
  • 2.5 Considerations About the Models of Chemical Bond in Use Before the Adoption of the Symmetry Molecular Orbital Model
  • 3 Perturbation Theory
  • 3.1 Interelectronic Repulsion Perturbation
  • 3.2 Spin-Orbit Coupling Perturbation
  • 3.3 Crystal Field Perturbation
  • 3.3.1 Use of the Group Theory to Predict the Orbital Spitting in a Given Symmetry
  • 3.4 Examples of Attribution of the Absorption Bands
  • 3.5 Crystal Field Limits
  • 3.6 Effect of Distortion from Cubic Symmetry
  • 4 Magnetism
  • 4.1 Interaction Between Electrons and Magnetic Field
  • 4.2 Magnetic Susceptibility Expression for S = 1/2
  • 4.3 Electron Spin Resonance
  • 4.3.1 Hyperfine Nuclear Interaction.
  • 4.3.2 Hyperfine Interaction by Quantum Mechanical Approach
  • 4.3.3 The Electronic Interaction with the Magnetic Field in Oriented Systems
  • 4.3.4 The Electronic Interaction with the Magnetic Field in Oriented Systems
  • 4.3.5 The Origin of the g Anisotropic Behavior
  • 4.3.6 g Expressions for a d1 Electronic Configuration in Tetragonal Symmetry Field
  • 4.3.7 g Tensor Dependence on the Energy Level Trend of the Paramagnetic Centers
  • 5 The Symmetry Properties Describe the Electronic Structure of Inorganic and Coordination Compounds
  • 5.1 The Case of [Fe3 Pt3 (CO)15]n− n = 2, 1, and of [Fe3 Pt3 (CO)15]2-n
  • 5.2 Discussion of the Case
  • 5.2.1 X-Ray Diffraction Studies
  • 5.2.2 Diffuse Reflectance Spectra
  • 5.2.3 Electron Spin Resonance (ESR) Spectra
  • 5.3 Chemical Message
  • 5.4 The Case of Adducts of NN'Ethylenebis (acetylacetoneiminato)Cobalt (II)
  • 5.5 Discussion of the Case
  • 5.6 Chemical Message
  • 5.7 The Case of Phthalocyaninato Co(II)
  • 5.8 Discussion of the Case
  • 5.8.1 Electron Spin Resonance (ESR) Spectra
  • 5.8.2 Diffuse Reflectance Spectra
  • 5.9 Chemical Message
  • 5.10 The Case of Oxygen Reduction by CoPc Supported on Inorganic Oxide
  • 5.11 Discussion of the Case
  • 5.12 Chemical Message
  • 5.13 The Case of Metal-Dispersed Inorganic Oxides
  • 5.14 Discussion of the Case
  • 5.14.1 Electron Spin Resonance of Decarbonylated Systems
  • 5.14.2 Interaction with Oxygen
  • 5.14.3 Interaction with Carbon Monoxide
  • 5.14.4 Interaction with Carbon Monoxide and Oxygen
  • 5.15 Chemical Message
  • 5.16 The Case of Phosphate Glasses Containing Ruthenium and Titanium Ions
  • 5.17 Discussion of the Case
  • 5.18 Chemical Message
  • 5.19 The Case of Superoxide Dismutase Enzyme, Interacting with Antitumor Drugs
  • 5.20 Discussion of the Case
  • 5.21 Chemical Message
  • 5.22 The Case of Generation of Free Radicals in Intact Tissues.
  • 5.23 Discussion of the Case
  • 5.24 Chemical Message
  • 5.25 The Case of Functional Defects in Semiconductor Oxides: ZnO
  • 5.26 Discussion of the Case
  • 5.27 Chemical Message
  • 5.28 The Case of Functional Defects in Semiconductor Oxides: SnO2
  • 5.29 Discussion of the Case
  • 5.29.1 Air Interaction with SnO2
  • 5.29.2 Argon Interaction with SnO2
  • 5.29.3 H2 and CO Interaction with SnO2, in the Presence of Air
  • 5.30 Chemical Message
  • 5.31 The Case: Enhancing of the Oxide Sensing Properties by Transition Metal Ions
  • 5.32 Discussion of the Case
  • 5.33 Chemical Message
  • 5.34 The Case of the Inhibitory Effect of Cu(II) Toward Protein Kinase C
  • 5.35 Discussion of the Case
  • 5.36 Chemical Message
  • 5.37 The Case of the Catalytic Oxidation of Propenoidic Phenols
  • 5.38 Discussion of the Case
  • 5.39 The Case of Sn-Doped Solgel Silica Glasses
  • 5.40 Discussion of the Case
  • 5.41 Chemical Message
  • 5.42 The Cases of Photocatalytic TiO2
  • 5.43 Discussion of the Case
  • 5.44 Chemical Message
  • 5.45 The Case of Shape-Controlled TiO2 Nanoparticles
  • 5.46 Discussion of the Case
  • 5.47 Chemical Message
  • 5.48 The Case of Charge Separation in TiO2 Embedded in Membrane
  • 5.49 Discussion of the Case
  • 5.50 Chemical Message
  • 5.51 The Case of Shape-Controlled SnO2
  • 5.52 Discussion of the Case
  • 5.52.1 Shape and Structure
  • 5.52.2 Identification of Defects
  • 5.52.3 Electrical Response
  • 5.53 Chemical Message
  • 5.54 The Case of Silica-Natural Rubber Composites
  • 5.54.1 Morphology of the Dispersed Filler
  • 5.54.2 Spin Probe Procedure
  • 5.55 Chemical Message
  • 5.56 The Case of Cis Diamino Dichloro Platinum (Cisplatin) Antitumor Drug [Pt(NH)3Cl2]: Mechanism of Combinational Chemo-radiotherapy
  • 5.57 Discussion of the Case
  • 5.58 Chemical Message
  • 5.59 The Case of Graphite Particles that Induce Reactive Oxygen Species in Cells.
  • 5.60 Discussion of the Case
  • 5.61 Chemical Message
  • 5.62 The Interaction of Graphite Defects with Oxygen Treated by Structural Studies
  • 5.63 Discussion of the Case
  • 5.63.1 Electrochemistry
  • 5.63.2 Electron Spin Resonance Measurements
  • 5.64 Chemical Message
  • 5.65 The Case of Persistent Free Radicals in the Atmosphere
  • 5.66 Discussion of the Case
  • 5.67 Chemical Message
  • Tables of Characters Used in the Reported Molecules are in Appendix
  • Tanabe and Sugano Diagrams
  • Character Tables for Relevant Symmetry Groups
  • Properties of Vectors
  • Properties of Matrices
  • References.
ISBN
3-030-62996-1
OCLC
1249471496
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