Double Deprotonation of CH3CN by an Iron–Aluminium Complex
DOI: 10.14469/hpc/12264 Metadata
Created: 2023-02-15 14:05
Last modified: 2023-05-09 11:39
License: Creative Commons: Attribution 4.0
Funding: P85489: "FluoroCycle - H2020".
Co-author: Mark Crimmin
Description
Raw Computational, NMR, and IR data for: Double Deprotonation of CH3CN by an Iron–Aluminium Complex
Files
| Filename | Size | Type | Description |
|---|---|---|---|
| Computational Data.zip | 131KB | application/zip | Computational Coordinates and Energies |
| Computational Data.mnpub | 0 | chemical/x-mnpub | Mestrenova signature file for Computational Data.zip |
| NMR.zip | 50MB | application/zip | Raw NMR data |
| NMR.mnpub | 0 | chemical/x-mnpub | Mestrenova signature file for NMR.zip |
| IR.zip | 218KB | application/zip | Raw IR data |
| IR.mnpub | 0 | chemical/x-mnpub | Mestrenova signature file for IR.zip |
Associated DOIs
| Current dataset ... | DOI | Description |
|---|---|---|
| isReferencedBy | 10.1002/anie.202219212 | Angewandte Chemie International Edition - VOR |
| isReferencedBy | 10.26434/chemrxiv-2022-26428 | ChemRxiv - Preprint |