Computational Organometallic Chemistry

Editors: Wiest, Olaf, Wu, Yundong (Eds.)

  • A snapshot of a large field which has expanded dramatically in recent years
  • Experts from Europe, Asia and the US write about their specialist area of computational organometallic chemistry
  • Inspiration for novel experimental studies
  •  
  • Experts from Europe, Asia and the US write about their specialist area of computational organometallic chemistry
  • Inspiration for novel experimental studies
  •  
  • Inspiration for novel experimental studies
  •  
see more benefits

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eBook $149.00
price for USA (gross)
  • ISBN 978-3-642-25258-7
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  • Included format: EPUB, PDF
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  • Immediate eBook download after purchase
Hardcover $199.00
price for USA
  • ISBN 978-3-642-25257-0
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  • Usually dispatched within 3 to 5 business days.
Softcover $199.00
price for USA
  • ISBN 978-3-642-44368-8
  • Free shipping for individuals worldwide
  • Usually dispatched within 3 to 5 business days.
About this book

Computational methods have become an indispensible tool for elucidating the mechanism of organometallic reactions. This snapshot of state-of-the-art computational studies provides an overview of the vast field of computational organometallic chemistry. Authors from Asia, Europe and the US have been selected to contribute a chapter on their specialist areas. Topics addressed include: DFT studies on zirconium-mediated reactions, force field methods in organometallic chemistry, hydrogenation of π-systems, oxidative functionalization of unactivated C-H bonds and olefins, the osmylation reaction, and cobalt carbonyl clusters. The breadth and depth of the contributions demonstrate not only the crucial role that computational methods play in the study of a wide range of organometallic reactions, but also attest the robust health of the field, which continues to benefit from, as well as inspire novel experimental studies.

Table of contents (8 chapters)

  • DFT Studies on Zirconium-Mediated Reactions

    Li, Yuxue

    Pages 1-18

  • Computational Organometallic Chemistry with Force Fields

    Huang, Jing (et al.)

    Pages 19-46

  • New Insights into the Molecular Mechanism of H2 Activation

    Zeng, Guixiang (et al.)

    Pages 47-60

  • Transition Metal-Catalyzed Hydrogenations

    Forbes, Aaron (et al.)

    Pages 61-112

  • Mechanistic Insights into Selective Oxidation of Light Alkanes by Transition Metal Compounds/Complexes

    Fu, Gang (et al.)

    Pages 113-141

Buy this book

eBook $149.00
price for USA (gross)
  • ISBN 978-3-642-25258-7
  • Digitally watermarked, DRM-free
  • Included format: EPUB, PDF
  • ebooks can be used on all reading devices
  • Immediate eBook download after purchase
Hardcover $199.00
price for USA
  • ISBN 978-3-642-25257-0
  • Free shipping for individuals worldwide
  • Usually dispatched within 3 to 5 business days.
Softcover $199.00
price for USA
  • ISBN 978-3-642-44368-8
  • Free shipping for individuals worldwide
  • Usually dispatched within 3 to 5 business days.
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Bibliographic Information

Bibliographic Information
Book Title
Computational Organometallic Chemistry
Editors
  • Olaf Wiest
  • Yundong Wu
Copyright
2012
Publisher
Springer-Verlag Berlin Heidelberg
Copyright Holder
Springer-Verlag Berlin Heidelberg
eBook ISBN
978-3-642-25258-7
DOI
10.1007/978-3-642-25258-7
Hardcover ISBN
978-3-642-25257-0
Softcover ISBN
978-3-642-44368-8
Edition Number
1
Number of Pages
VIII, 256
Topics