| Titre : |
Computional methods in organometallic catalysis : From elementary reactions to mechanisms - With a foreword by Kendall N. Houk |
| Type de document : |
texte imprimé |
| Auteurs : |
Lan, Yu, Auteur |
| Editeur : |
Wiley-VCH Verlag |
| Année de publication : |
2021 |
| Importance : |
xviii, 648 p. |
| ISBN/ISSN/EAN : |
978-3-527-34601-1 |
| Note générale : |
In Computational Methods in Organometallic Catalysis: From Elementary Reactions to Mechanisms, distinguished chemist and author Yu Lan delivers a synthesis of the use of calculation methods and experimental techniques to improve the efficiency of reaction and yield of product and to uncover the factors that control the selectivity of product. Providing not only a theoretical overview of organometallic catalysis, the book also describes computational studies for the mechanism of transition-metal-assisted reactions.
You’ll learn about Ni-, Pd-, Pt-, Co-, Rh-, Ir-, Fe-, Ru-, Mn-, Cu-, Ag-, and Au- catalysis. You’ll also discover many of the experimental and theoretical advances in organometallic catalysis reported in the recent literature. The book summarizes and generalizes the advances made in the mechanistic study of organometallic catalysis. |
| Langues : |
Anglais (eng) |
| Catégories : |
Chimie théorique
|
| Tags : |
COMPUTATIONAL CHEMISTRY |
| Index. décimale : |
B-H |
| Résumé : |
Readers will also benefit from the inclusion of:
A thorough introduction to computational organometallic chemistry, including a brief history of the discipline and the use of computational tools to study the mechanism of organometallic chemistry.
An exploration of computational methods in organometallic chemistry, including density functional theory methods and basis sets and their application in mechanism studies
A practical discussion of elementary reactions in organometallic chemistry, including coordination and dissociation, oxidative addition, reductive elimination, insertion, elimination, transmetallation, and metathesis
A concise treatment of the theoretical study of transition-metal catalysis. |
| Note de contenu : |
"* 1 Introduction of Computational Organometallic Chemistry
2 Computational Methods in Organometallic Chemistry
3 Elementary Reactions in Organometallic Chemistry
4 Theoretical Study of Ni-Catalysis
5 Theoretical Study of Pd-Catalysis
6 Theoretical Study of Pt-Catalysis
7 Theoretical Study of Co-Catalysis
8 Theoretical Study of Rh-Catalysis
9 Theoretical Study of Ir-Catalysis
10 Theoretical Study of Fe-Catalysis
11 Theoretical Study of Ru-Catalysis
12 Theoretical Study of Mn-Catalysis
13 Theoretical Study of Cu-Catalysis
14 Theoretical Study of Ag-Catalysis
15 Theoretical Study of Au-Catalysis". |
| Cote : |
B-H080 |
| Num_Inv : |
3622 |
| Localisation : |
LCC (SdS) |
Computional methods in organometallic catalysis : From elementary reactions to mechanisms - With a foreword by Kendall N. Houk [texte imprimé] / Lan, Yu, Auteur . - Wiley-VCH Verlag, 2021 . - xviii, 648 p. ISBN : 978-3-527-34601-1 In Computational Methods in Organometallic Catalysis: From Elementary Reactions to Mechanisms, distinguished chemist and author Yu Lan delivers a synthesis of the use of calculation methods and experimental techniques to improve the efficiency of reaction and yield of product and to uncover the factors that control the selectivity of product. Providing not only a theoretical overview of organometallic catalysis, the book also describes computational studies for the mechanism of transition-metal-assisted reactions.
You’ll learn about Ni-, Pd-, Pt-, Co-, Rh-, Ir-, Fe-, Ru-, Mn-, Cu-, Ag-, and Au- catalysis. You’ll also discover many of the experimental and theoretical advances in organometallic catalysis reported in the recent literature. The book summarizes and generalizes the advances made in the mechanistic study of organometallic catalysis. Langues : Anglais ( eng)
| Catégories : |
Chimie théorique
|
| Tags : |
COMPUTATIONAL CHEMISTRY |
| Index. décimale : |
B-H |
| Résumé : |
Readers will also benefit from the inclusion of:
A thorough introduction to computational organometallic chemistry, including a brief history of the discipline and the use of computational tools to study the mechanism of organometallic chemistry.
An exploration of computational methods in organometallic chemistry, including density functional theory methods and basis sets and their application in mechanism studies
A practical discussion of elementary reactions in organometallic chemistry, including coordination and dissociation, oxidative addition, reductive elimination, insertion, elimination, transmetallation, and metathesis
A concise treatment of the theoretical study of transition-metal catalysis. |
| Note de contenu : |
"* 1 Introduction of Computational Organometallic Chemistry
2 Computational Methods in Organometallic Chemistry
3 Elementary Reactions in Organometallic Chemistry
4 Theoretical Study of Ni-Catalysis
5 Theoretical Study of Pd-Catalysis
6 Theoretical Study of Pt-Catalysis
7 Theoretical Study of Co-Catalysis
8 Theoretical Study of Rh-Catalysis
9 Theoretical Study of Ir-Catalysis
10 Theoretical Study of Fe-Catalysis
11 Theoretical Study of Ru-Catalysis
12 Theoretical Study of Mn-Catalysis
13 Theoretical Study of Cu-Catalysis
14 Theoretical Study of Ag-Catalysis
15 Theoretical Study of Au-Catalysis". |
| Cote : |
B-H080 |
| Num_Inv : |
3622 |
| Localisation : |
LCC (SdS) |
|  |
Computional methods in organometallic catalysis
