Exploring the intermediates of photochemical CO 2 reduction

Reaction of Re(dmb)(CO) 3 COOH with CO 2

Jay Agarwal, Brian C. Sanders, Etsuko Fujita, Henry F. Schaefer, Todd C. Harrop, James Muckerman

Research output: Contribution to journalArticle

26 Citations (Scopus)

Abstract

We have investigated the reaction of Re(dmb)(CO) 3COOH with CO 2 using density functional theory, and propose a mechanism for the production of CO. This mechanism supports the role of Re(dmb)(CO) 3COOH as a key intermediate in the formation of CO. Our new experimental work supports the proposed scheme.

Original languageEnglish
Pages (from-to)6797-6799
Number of pages3
JournalChemical Communications
Volume48
Issue number54
DOIs
Publication statusPublished - Jul 11 2012

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Carbon Monoxide
Density functional theory

ASJC Scopus subject areas

  • Metals and Alloys
  • Materials Chemistry
  • Surfaces, Coatings and Films
  • Electronic, Optical and Magnetic Materials
  • Ceramics and Composites
  • Catalysis
  • Chemistry(all)

Cite this

Exploring the intermediates of photochemical CO 2 reduction : Reaction of Re(dmb)(CO) 3 COOH with CO 2. / Agarwal, Jay; Sanders, Brian C.; Fujita, Etsuko; Schaefer, Henry F.; Harrop, Todd C.; Muckerman, James.

In: Chemical Communications, Vol. 48, No. 54, 11.07.2012, p. 6797-6799.

Research output: Contribution to journalArticle

Agarwal, Jay ; Sanders, Brian C. ; Fujita, Etsuko ; Schaefer, Henry F. ; Harrop, Todd C. ; Muckerman, James. / Exploring the intermediates of photochemical CO 2 reduction : Reaction of Re(dmb)(CO) 3 COOH with CO 2. In: Chemical Communications. 2012 ; Vol. 48, No. 54. pp. 6797-6799.
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