CCDC 2102346: Experimental Crystal Structure

A single experimental crystal structure determination, deposited with The Cambridge Crystallographic Data Centre (CCDC). The dataset provides atomic coordinates and structural parameters for a specific chemical compound, identified by the CCDC reference code 2102346. It is available under an open license for reuse in scientific research.

Use Cases

• Validating computational chemistry models against an experimental crystal structure.
• Analyzing bond lengths and angles for structural chemistry research.
• Using as a reference structure for molecular docking or drug design studies.
• Teaching crystallographic principles with a real-world dataset.

Strengths

• Data is curated and hosted by the authoritative Cambridge Crystallographic Data Centre (CCDC).
• Available under a permissive CC-BY-4.0 license, facilitating open reuse.

Limitations

• Dataset scale is limited to a single crystal structure determination.
• Metadata on column names, row count, and file format is not provided in the source descriptions.
• The author's organization is not specified, limiting provenance details.

Provenance

Source

The Cambridge Crystallographic Data Centre (CCDC)

Collection Method

Experimental crystal structure determination.

Freshness

Last updated on 2026-03-23.