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Bringing Ir(C^C)3 Photocatalysts into the visible: mer-Ir(pmp)3 as a strongly photoreducing and stable photocatalyst for metallaphotoredox catalysis (dataset)

Dataset

Description

The open data folder includes four sub-folders: Compound characterization, computations, optoelectronic characterization and photocatalysis
The Compound Characterization folder includes NMR (FID, PDF and MNova files) and GCMS (PDF) data of the intermediates and complexes.
The computations folder contains the .log and .com (or .gjf) files for investigated compounds.
The Optoelectronics folder includes two sub-folders: Electrochemical characterization and Photophysical charcterization. The Electrochemical characterization folder includes the raw data of CV and DPV measurements (the CSV file saved from the instrument) and the Origin files used for plotting spectra. The Photophysics folder includes the raw data (the CSV file saved from the instrument) and Origin files of UV-vis absorption spectra, SSPL (rt and 77 K) and TRPL in solution.
The photocatalysis folder contains NMR (FID, PDF and MNova files) of all of the crude photocatalysis reaction mixtures, and the stability studies, GCMS (PDF) of the cross-coupled products and the origin files used for plotting the Stern-Volmer quenching experiments (UV-Vis and emission).
Date made available25 Mar 2026
PublisherUniversity of St Andrews

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