Supplementary Material for BN/BO Helicene Quantum Yield Study

A 945.0 KB PDF file containing supplementary theoretical data for a study on high-quantum-yield helicenes. The material, authored by Shiling Wang and last updated on 2026-04-09, includes vibrational spectra, molecular orbital energy gaps, absorption spectra, and performance comparisons of different vibronic models for BN- and BO-substituted [6]helicenes.

Use Cases

• Benchmarking vibronic models (AH, ASF, AS) based on the performance comparison data mentioned in the description
• Analyzing the origin of spectral broadening in circularly polarized luminescence (CPL) based on the analysis provided for BO[6]
• Comparing absorption and electronic circular dichroism (ECD) spectra based on the spectra provided for all three helicenes
• Studying the relationship between molecular orbital energy gaps and quantum yield based on the key MO energy gap data

Strengths

• File size is precisely 945.0 KB, indicating a focused supplementary document.
• The description lists specific theoretical analyses, such as vibrational spectra and vibronic model comparisons.
• Has a clear CC-BY-4.0 license for open reuse.

Limitations

• Row count and column-level documentation are absent; data structure must be inferred from the PDF.
• The dataset is a single 945.0 KB PDF, which is a very limited scope for direct computational analysis.

Provenance

Source

figshare, authored by Shiling Wang.

Collection Method

Theoretical computational methods, as described.

Time Range

Publication date implied by last update of 2026-04-09.

Freshness

Last updated 2026 04 09 12:05:31.

Geography

null