[3]Rotaxanes with Mixed Axles: Polyynes and Cumulenes
Bibliographic record
Abstract
Tailoring synthetic strategies toward complex, but well‐defined, molecular architectures is an important aspect of Today's organic chemistry. Herein, we present designs to build up [3]rotaxanes of Type 2.1 and Type 3 that feature both a polyyne and a cumulene axle in a single mechanically interlocked molecule. The combination of two sp ‐hybridized carbon chains was achieved by functionalization of a phenanthroline‐based macrocycle, which allowed the coupling of two [2]rotaxanes toward Type 3 [3]rotaxanes with two polyynes, two cumulenes, or one polyyne and one cumulene axle. The structures have been established by NMR and UV/Vis spectroscopies, as well as high‐resolution mass spectrometry. A [3]rotaxane of Type 3 , featuring two [9]cumulene axles, has been assembled and spectroscopically characterized despite expectations that it would be unstable. This represents only the second cumulene rotaxane reported to date. All designs and attempts to form [3]rotaxanes of Type 2.1 , which combine a polyyne and cumulene threaded through a single macrocycle, have been unsuccessful.
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How this classification was reachedexpand
Full frame distilled prediction
Teacher imitationNot calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.
Codex and Gemma teacher scores by category
| Category | Codex | Gemma |
|---|---|---|
| Metaresearch | 0.000 | 0.000 |
| Meta-epidemiology (narrow) | 0.000 | 0.000 |
| Meta-epidemiology (broad) | 0.000 | 0.000 |
| Bibliometrics | 0.000 | 0.000 |
| Science and technology studies | 0.000 | 0.000 |
| Scholarly communication | 0.000 | 0.000 |
| Open science | 0.000 | 0.000 |
| Research integrity | 0.000 | 0.000 |
| Insufficient payload (model declined to judge) | 0.006 | 0.000 |
Machine scores (provisional)
The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.
Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.
score_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from itClassification
machine, unvalidatedMachine predicted; a candidate call from one teacher head, not a consensus.
How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".