Research output per year
Research output per year
Description
Density Functional Theory (DFT) log files and selected fchk files (for species with spin density presented), for the following paper:
Electron Transfer and Hydride Transfer Pathways in the Stoltz-Grubbs Reducing System (KOtBu-Et3SiH)
Electron Transfer and Hydride Transfer Pathways in the Stoltz-Grubbs Reducing System (KOtBu-Et3SiH)
| Date made available | 12 Sept 2017 |
|---|---|
| Publisher | University of Strathclyde |
| Date of data production | Oct 2016 - Sept 2017 |
Research output
- 1 Article
-
Electron transfer and hydride transfer pathways in the Stoltz-Grubbs reducing system (KOtBu-Et3SiH)
Smith, A. J., Young, A., Rohrbach, S., O'Connor, E. F., Allison, M., Wang, H.-S., Poole, D. L., Tuttle, T. & Murphy, J. A., 23 Oct 2017, In: Angewandte Chemie International Edition. 56, 44, p. 13747–13751 5 p.Research output: Contribution to journal › Article › peer-review
Open AccessFile48 Citations (Scopus)67 Downloads (Pure)
Datasets
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Electron Transfer and Hydride Transfer Pathways in the Stoltz-Grubbs Reducing System (KOtBu-Et3SiH) - Compounds 54 - 59
Rohrbach, S. (Creator), University of Strathclyde, 12 Sept 2017
DOI: 10.15129/554c14c0-b996-4345-b9a0-e8ea1ef78dc0
Dataset
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Electron Transfer and Hydride Transfer Pathways in the Stoltz-Grubbs Reducing System Data for Compounds 15-50
Smith, A. (Creator), University of Strathclyde, 12 Sept 2017
DOI: 10.15129/fa911a99-4c39-440c-8834-096263b63695
Dataset