Catalytic CO Homologation at Magnesium: Experimental and Computational Data

Experimental data and likely computational results from a study on the catalytic homologation of carbon monoxide using a magnesium alkyl complex. The dataset, authored by Richard Y. Kong and last updated on June 3, 2026, is shared under a CC-BY-NC-4.0 license. It is a small dataset with a file size of 210.2 KB, containing files in the XYZ format.

Use Cases

• Training machine learning models for catalyst discovery based on reaction pathway data.
• Benchmarking computational chemistry methods against experimental bimetallic intermediate structures.
• Analyzing reaction mechanisms for CO homologation distinct from transition-metal cycles.

Strengths

• Dataset is associated with a peer-reviewed scientific report detailing a new catalytic approach.
• Includes data from single-turnover experiments and isolated bimetallic intermediates.
• File format (XYZ) suggests the presence of 3D molecular coordinate data.

Limitations

• Row count is unknown, which may limit suitability assessment.
• Column-level documentation is absent; field semantics must be inferred after download.
• The dataset's 210.2 KB size indicates a very limited scope of data points.

Provenance

Source

figshare, author Richard Y. Kong

Collection Method

Likely generated from laboratory experiments and computational chemistry calculations.

Freshness

Last updated 2026-06-03 07:17:21; freshness should be verified