Interplay between Terminal and Bridging Diiron Hydrides in Neutral and Oxidized States

Xin Yu, Chen-Ho Tung, Wenguang Wang, Mioy T. Huynh, Danielle L. Gray, Sharon Hammes-Schiffer, Thomas B. Rauchfuss
2017 Organometallics  
Experimental details, NMR ( 1 H, 31 P) and IR spectra, comparison of experimentally measured and DFT calculated structures, redox potentials, and ν CO values, calculated reaction free energies and spin densities, coordinates and energies of all optimized structures, and crystallographic data (PDF)
doi:10.1021/acs.organomet.7b00297 pmid:28781408 pmcid:PMC5538148 fatcat:hlh66rbwt5bqzknng2rulaztmy