Alternative modes of bonding of C4F8 units in mononuclear and binuclear iron carbonyl complexes-Reference-Cited by-同舟云学术

Alternative modes of bonding of C4F8 units in mononuclear and binuclear iron carbonyl complexes

Published:2019 Issue:18 Volume:43 Page:6932-6942
ISSN:1144-0546
Container-title:New Journal of Chemistry
language:en
Short-container-title:New J. Chem.

Author:

Huang Liping¹²³⁴⁵,Li Jing¹²³⁴⁵,Li Guoliang¹²³⁴⁵,Xie Yaoming⁶⁷⁸⁹,King R. Bruce⁶⁷⁸⁹^ORCID,Schaefer Henry F.⁶⁷⁸⁹^ORCID

Affiliation:

1. Key Laboratory of Theoretical Chemistry of the Environment

2. Ministry of Education

3. Center for Computational Quantum Chemistry

4. School of Chemistry and Environment

5. South China Normal University

6. Department of Chemistry and Center for Computational Quantum Chemistry

7. University of Georgia

8. Athens

9. USA

Abstract

The lowest energy C₄F₈Fe(CO)₄ structure is not the experimentally known ferracyclopentane complex but instead isomeric (perfluorobutene)iron tetracarbonyls. However, activation energies for the fluorine shifts required to form the latter isomers are very high. The lowest energy (C₄F₈)₂Fe₂(CO)_n (n = 7, 6) structures have bridging perfluorocarbene and terminal perfluoroolefin ligands.

Funder

Division of Chemistry

Publisher

Royal Society of Chemistry (RSC)

Subject

Materials Chemistry,General Chemistry,Catalysis

Link

http://pubs.rsc.org/en/content/articlepdf/2019/NJ/C9NJ00882A

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