| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 7751217 | Inorganica Chimica Acta | 2015 | 8 Pages |
Abstract
The lowest energy (aceheptylene)Fe3(CO)8 structure is the experimental structure with separate (diene)Fe(CO)3 and (azulene)Fe2(CO)5 subunits. The lowest energy (aceheptylene)Fe3(CO)9 precursor to this experimental structure has three separate (diene)Fe(CO)3 subunits and an uncomplexed CC double bond. Related (heptalene)Fe3(CO)n (n = 9, 8) structures are also optimized and suggested to be viable species.
Related Topics
Physical Sciences and Engineering
Chemistry
Inorganic Chemistry
Authors
Hui Wang, Hongyan Wang, Mingzhen Jia, R. Bruce King,